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2025-04-16 00:00:00
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|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
[
"Al",
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] | 20 |
A3BC
|
AlFeO3
|
Al4 Fe4 O12
| 3 |
[
1,
1,
1
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agm005266162
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|
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2024-05-07 00:00:00
|
[
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pbe
| true | 2 |
agm005266162-pbe-96
| 96 | 0 |
[
"Al",
"Fe",
"O"
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A3BC
|
AlFeO3
|
Al4 Fe4 O12
| 3 |
[
1,
1,
1
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[
[
4.93546498,
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agm005266162
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|
[
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2024-05-07 00:00:00
|
[
0.2,
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0.6
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[
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pbe
| true | 2 |
agm005266162-pbe-97
| 97 | 0 |
[
"Al",
"Fe",
"O"
] | 20 |
A3BC
|
AlFeO3
|
Al4 Fe4 O12
| 3 |
[
1,
1,
1
] | 3 |
[
[
4.93110954,
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0.05094422
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[
0.11706819,
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agm005266162
|
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3.839048316641644,
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[{"mass": null, "name": "Al", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Al"]}, {"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
|
[
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2024-05-07 00:00:00
|
[
0.2,
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0.6
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[
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pbe
| true | 2 |
agm005266162-pbe-98
| 98 | 0 |
[
"Al",
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"O"
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A3BC
|
AlFeO3
|
Al4 Fe4 O12
| 3 |
[
1,
1,
1
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[
[
4.93048827,
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0.11636408,
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agm005266162
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|
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2024-05-07 00:00:00
|
[
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pbe
| true | 2 |
agm005266162-pbe-99
| 99 | 0 |
[
"Mn",
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A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
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1
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agm005266163
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[
"Mn",
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2024-05-07 00:00:00
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pbe
| true | 160 |
agm005266163-pbe-0
| 0 | 0 |
[
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A2B
|
MnO2
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Mn4 O8
| 2 |
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1
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agm005266163
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|
[
"Mn",
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2024-05-07 00:00:00
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pbe
| true | 160 |
agm005266163-pbe-1
| 1 | 0 |
[
"Mn",
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A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
1,
1
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agm005266163
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|
[
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2024-05-07 00:00:00
|
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pbe
| true | 160 |
agm005266163-pbe-10
| 10 | 0 |
[
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A2B
|
MnO2
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Mn4 O8
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1
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agm005266163
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|
[
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
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| 11 | 0 |
[
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A2B
|
MnO2
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Mn4 O8
| 2 |
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1
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agm005266163
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2024-05-07 00:00:00
|
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pbe
| true | 160 |
agm005266163-pbe-12
| 12 | 0 |
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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agm005266163
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
agm005266163-pbe-13
| 13 | 0 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 14 | 0 |
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MnO2
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Mn4 O8
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 15 | 0 |
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A2B
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MnO2
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Mn4 O8
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agm005266163
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|
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 16 | 0 |
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MnO2
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Mn4 O8
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|
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 17 | 0 |
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A2B
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MnO2
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Mn4 O8
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agm005266163
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2024-05-07 00:00:00
|
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pbe
| true | 160 |
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| 18 | 0 |
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A2B
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MnO2
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 19 | 0 |
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A2B
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MnO2
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 2 | 0 |
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A2B
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MnO2
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Mn4 O8
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 20 | 0 |
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A2B
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MnO2
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Mn4 O8
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 21 | 0 |
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A2B
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MnO2
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Mn4 O8
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 22 | 0 |
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A2B
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MnO2
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Mn4 O8
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2024-05-07 00:00:00
|
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pbe
| true | 160 |
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| 23 | 1 |
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A2B
|
MnO2
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Mn4 O8
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
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| 24 | 1 |
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A2B
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MnO2
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Mn4 O8
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agm005266163
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2024-05-07 00:00:00
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pbe
| true | 160 |
agm005266163-pbe-25
| 25 | 1 |
[
"Mn",
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A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
1,
1
] | 3 |
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agm005266163
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|
[
"Mn",
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2024-05-07 00:00:00
|
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pbe
| true | 160 |
agm005266163-pbe-26
| 26 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1,
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1
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agm005266163
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|
[
"Mn",
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2024-05-07 00:00:00
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[
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pbe
| true | 160 |
agm005266163-pbe-27
| 27 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
1,
1
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[
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agm005266163
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|
[
"Mn",
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
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| 28 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1,
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1
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[
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agm005266163
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|
[
"Mn",
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
agm005266163-pbe-29
| 29 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1,
1
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[
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agm005266163
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|
[
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
agm005266163-pbe-3
| 3 | 0 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1,
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1
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[
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agm005266163
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|
[
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
agm005266163-pbe-30
| 30 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1,
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1
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[
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agm005266163
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|
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"Mn",
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2024-05-07 00:00:00
|
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pbe
| true | 160 |
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| 31 | 1 |
[
"Mn",
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1,
1,
1
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agm005266163
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|
[
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2024-05-07 00:00:00
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pbe
| true | 160 |
agm005266163-pbe-32
| 32 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
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1,
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1
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agm005266163
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|
[
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2024-05-07 00:00:00
|
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pbe
| true | 160 |
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| 33 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
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1
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[
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agm005266163
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|
[
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
agm005266163-pbe-34
| 34 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
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1
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[
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agm005266163
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|
[
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
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| 35 | 1 |
[
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A2B
|
MnO2
|
Mn4 O8
| 2 |
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1
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agm005266163
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|
[
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2024-05-07 00:00:00
|
[
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pbe
| true | 160 |
agm005266163-pbe-4
| 4 | 0 |
[
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A2B
|
MnO2
|
Mn4 O8
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1
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[
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agm005266163
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|
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"O",
"O"
] |
2024-05-07 00:00:00
|
[
0.3333333333333333,
0.6666666666666666
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[
[
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0,
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0
],
[
0.38437285,
0,
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]
] | -83.080219 | -95.248219 |
[
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[
0.04322189,
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]
] |
pbe
| true | 160 |
agm005266163-pbe-5
| 5 | 0 |
[
"Mn",
"O"
] | 12 |
A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
1,
1
] | 3 |
[
[
5.25396204,
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0.01658643
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5.25396204,
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[
3.62218499,
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agm005266163
|
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[
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
|
[
"Mn",
"Mn",
"Mn",
"Mn",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] |
2024-05-07 00:00:00
|
[
0.3333333333333333,
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[
[
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0,
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[
0.67511214,
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] | -83.081246 | -95.249246 |
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[
0.01450561,
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0.00519456
]
] |
pbe
| true | 160 |
agm005266163-pbe-6
| 6 | 0 |
[
"Mn",
"O"
] | 12 |
A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
1,
1
] | 3 |
[
[
5.26062756,
-2.91377674,
0.01927857
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[
5.26062756,
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[
3.62923159,
0,
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agm005266163
|
[
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[
10.002744862908088,
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
|
[
"Mn",
"Mn",
"Mn",
"Mn",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] |
2024-05-07 00:00:00
|
[
0.3333333333333333,
0.6666666666666666
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[
[
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[
0,
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0
],
[
0.24524506,
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] | -83.082446 | -95.250446 |
[
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[
0.02540967,
0,
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[
0.0284356,
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0.00641606
]
] |
pbe
| true | 160 |
agm005266163-pbe-7
| 7 | 0 |
[
"Mn",
"O"
] | 12 |
A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
1,
1
] | 3 |
[
[
5.2679927,
-2.91302468,
0.02225328
],
[
5.2679927,
2.91302468,
0.02225328
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[
3.6370178,
0,
4.79687988
]
] |
agm005266163
|
[
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[
10.019013589594373,
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4.223578189887997
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
|
[
"Mn",
"Mn",
"Mn",
"Mn",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] |
2024-05-07 00:00:00
|
[
0.3333333333333333,
0.6666666666666666
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[
[
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[
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0
],
[
-0.24017512,
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]
] | -83.083062 | -95.251062 |
[
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[
0.03693227,
0,
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[
0.04356362,
0.01184402,
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]
] |
pbe
| true | 160 |
agm005266163-pbe-8
| 8 | 0 |
[
"Mn",
"O"
] | 12 |
A2B
|
MnO2
|
Mn4 O8
| 2 |
[
1,
1,
1
] | 3 |
[
[
5.27027963,
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0.02393964
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[
5.27027963,
2.91154106,
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[
3.64013539,
0,
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]
] |
agm005266163
|
[
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[
10.026434632190032,
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4.225034163537415
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
|
[
"Mn",
"Mn",
"Mn",
"Mn",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] |
2024-05-07 00:00:00
|
[
0.3333333333333333,
0.6666666666666666
] |
[
[
0.16477224,
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[
0,
1.20631741,
0
],
[
-0.35578364,
0,
1.08478452
]
] | -83.084051 | -95.252051 |
[
[
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0,
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0.01513387,
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0.01893229,
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0.01513387,
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[
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0,
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[
0.01271538,
0.00004565,
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]
] |
pbe
| true | 160 |
agm005266163-pbe-9
| 9 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.457257,
-5.7855245,
0
],
[
3.457257,
5.7855245,
0
],
[
0,
0,
5.252797
]
] |
agm005266167
|
[
[
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2.6263985
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[
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0.9418371044039999,
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[
3.457257,
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0
],
[
3.4572570000000002,
3.9649703634870006,
2.6263985
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-1.61103766,
0,
0
],
[
0,
1.933945,
0
],
[
0,
0,
-0.31015582
]
] | -16.621786 | -16.621786 |
[
[
0,
0.02347978,
0
],
[
-0.01873834,
0.01334062,
0
],
[
0.01873834,
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0
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[
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0.0188984,
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[
0,
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0
],
[
0,
-0.0276962,
0
],
[
0,
0.05267835,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-0
| 0 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.45285183,
-5.79437387,
0
],
[
3.45285183,
5.79437387,
0
],
[
0,
0,
5.25150847
]
] |
agm005266167
|
[
[
3.45285183,
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2.625754235
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[
1.6959321231203917,
0.9439222771943389,
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5.40533495298307,
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0
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[
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[
3.45285183,
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0
],
[
3.45285183,
3.973580303497756,
2.625754235
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-1.22865817,
0,
0
],
[
0,
1.57069627,
0
],
[
0,
0,
-0.14425262
]
] | -16.622744 | -16.622744 |
[
[
0,
0.01551035,
0
],
[
-0.01741904,
0.01058963,
0
],
[
0.01741904,
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0
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[
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0
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[
0.01284718,
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0
],
[
0,
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0
],
[
0,
-0.02568644,
0
],
[
0,
0.04875041,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-1
| 1 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43585717,
-5.83373874,
0
],
[
3.43585717,
5.83373874,
0
],
[
0,
0,
5.25291151
]
] |
agm005266167
|
[
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1.6739842123057018,
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[
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5.371639852155306,
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0
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[
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3.43585717,
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0
],
[
3.43585717,
4.062292819434129,
2.626455755
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.00111871,
0,
0
],
[
0,
0.30514903,
0
],
[
0,
0,
-0.15876567
]
] | -16.626261 | -16.626261 |
[
[
0,
-0.00247961,
0
],
[
0.02900862,
-0.01716317,
0
],
[
-0.02900862,
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0
],
[
-0.00338495,
-0.0004275,
0
],
[
0.00338495,
-0.0004275,
0
],
[
0,
0.00162303,
0
],
[
0,
0.01634402,
0
],
[
0,
0.0196939,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-10
| 10 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24924381,
-6.82161919,
0
],
[
3.24924381,
6.82161919,
0
],
[
0,
0,
4.9971651
]
] |
agm005266167
|
[
[
3.2492438099999994,
-2.8012276576958426,
2.49858255
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[
1.7576587810944493,
0.8852945262674061,
2.49858255
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[
4.74082883890555,
0.8852945262674066,
2.49858255
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[
1.5712320528132993,
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0
],
[
4.9272555671867,
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0
],
[
3.2492438099999994,
2.7903052903459664,
0
],
[
3.24924381,
-5.238256434186311,
0
],
[
3.2492438099999994,
5.450465001137436,
2.49858255
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.01954102,
0,
0
],
[
0,
0.10549383,
0
],
[
0,
0,
-0.00681688
]
] | -16.734767 | -16.734767 |
[
[
0,
-0.00910362,
0
],
[
0.0062493,
-0.00126312,
0
],
[
-0.0062493,
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0
],
[
-0.00426075,
0.00122723,
0
],
[
0.00426075,
0.00122723,
0
],
[
0,
-0.01052731,
0
],
[
0,
0.00809443,
0
],
[
0,
0.01160827,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-100
| 100 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24934181,
-6.82173303,
0
],
[
3.24934181,
6.82173303,
0
],
[
0,
0,
4.99682895
]
] |
agm005266167
|
[
[
3.24934181,
-2.801164165713526,
2.498414475
],
[
1.7578306220315412,
0.885320419593582,
2.498414475
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[
4.740852997968458,
0.8853204195935813,
2.498414475
],
[
1.5713090765265467,
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0
],
[
4.927374543473453,
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0
],
[
3.2493418100000007,
2.790462230936062,
0
],
[
3.24934181,
-5.238715362419367,
0
],
[
3.24934181,
5.451000736145278,
2.498414475
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.02702039,
0,
0
],
[
0,
0.11199519,
0
],
[
0,
0,
0.00388957
]
] | -16.734767 | -16.734767 |
[
[
0,
-0.009947,
0
],
[
0.00638888,
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0
],
[
-0.00638888,
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0
],
[
-0.00423966,
0.00168464,
0
],
[
0.00423966,
0.00168464,
0
],
[
0,
-0.01106601,
0
],
[
0,
0.00809024,
0
],
[
0,
0.01210556,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-101
| 101 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24943075,
-6.82183635,
0
],
[
3.24943075,
6.82183635,
0
],
[
0,
0,
4.99652385
]
] |
agm005266167
|
[
[
3.24943075,
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2.498261925
],
[
1.757986552951275,
0.8853439247189883,
2.498261925
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[
4.7408749470487255,
0.8853439247189883,
2.498261925
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[
1.5713789912093477,
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0
],
[
4.927482508790653,
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0
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[
3.24943075,
2.7906045025926898,
0
],
[
3.24943075,
-5.239131841642986,
0
],
[
3.24943075,
5.451486875267959,
2.498261925
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.03589529,
0,
0
],
[
0,
0.12130075,
0
],
[
0,
0,
0.02128331
]
] | -16.734767 | -16.734767 |
[
[
0,
-0.01057862,
0
],
[
0.00629037,
-0.00085811,
0
],
[
-0.00629037,
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0
],
[
-0.00452991,
0.0019434,
0
],
[
0.00452991,
0.0019434,
0
],
[
0,
-0.01086673,
0
],
[
0,
0.00874866,
0
],
[
0,
0.01052612,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-102
| 102 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25024216,
-6.82470928,
0
],
[
3.25024216,
6.82470928,
0
],
[
0,
0,
4.99515854
]
] |
agm005266167
|
[
[
3.25024216,
-2.8034483452826047,
2.49757927
],
[
1.7600300514222975,
0.8856335146493501,
2.49757927
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[
4.740454268577702,
0.8856335146493501,
2.49757927
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[
1.571186886621176,
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0
],
[
4.9292974333788235,
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0
],
[
3.25024216,
2.790571347318915,
0
],
[
3.25024216,
-5.24176669092826,
0
],
[
3.25024216,
5.457687252611456,
2.49757927
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.02144187,
0,
0
],
[
0,
0.08567162,
0
],
[
0,
0,
0.00442001
]
] | -16.734835 | -16.734835 |
[
[
0,
-0.00738006,
0
],
[
0.00337702,
0.00060477,
0
],
[
-0.00337702,
0.00060477,
0
],
[
-0.00343417,
0.00383995,
0
],
[
0.00343417,
0.00383995,
0
],
[
0,
-0.00950551,
0
],
[
0,
0.00515269,
0
],
[
0,
0.00284343,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-103
| 103 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25185915,
-6.83043446,
0
],
[
3.25185915,
6.83043446,
0
],
[
0,
0,
4.99243777
]
] |
agm005266167
|
[
[
3.25185915,
-2.8081168766739966,
2.496218885
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[
1.7641038994009608,
0.886210279230301,
2.496218885
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[
4.73961440059904,
0.8862102792303013,
2.496218885
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[
1.5708034408359612,
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0
],
[
4.932914859164038,
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0
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[
3.25185915,
2.790503235331995,
0
],
[
3.25185915,
-5.247018033829923,
0
],
[
3.2518591500000005,
5.470049614687208,
2.496218885
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.03223605,
0,
0
],
[
0,
-0.02111455,
0
],
[
0,
0,
-0.04590476
]
] | -16.734887 | -16.734887 |
[
[
0,
-0.00213304,
0
],
[
-0.00285743,
0.00197649,
0
],
[
0.00285743,
0.00197649,
0
],
[
-0.00123345,
0.00693629,
0
],
[
0.00123345,
0.00693629,
0
],
[
0,
-0.00801507,
0
],
[
0,
-0.0026048,
0
],
[
0,
-0.00507265,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-104
| 104 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25133823,
-6.82859007,
0
],
[
3.25133823,
6.82859007,
0
],
[
0,
0,
4.99331427
]
] |
agm005266167
|
[
[
3.2513382300000004,
-2.8066130686550417,
2.496657135
],
[
1.7627916387529012,
0.8860244479088526,
2.496657135
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[
4.739884821247099,
0.8860244479088522,
2.496657135
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[
1.5709268859489889,
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0
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[
4.931749574051011,
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0
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[
3.25133823,
2.790525047021922,
0
],
[
3.25133823,
-5.245326423834535,
0
],
[
3.25133823,
5.466067699580958,
2.496657135
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.02098526,
0,
0
],
[
0,
0.00938386,
0
],
[
0,
0,
-0.03006984
]
] | -16.734877 | -16.734877 |
[
[
0,
-0.00578563,
0
],
[
-0.00081183,
0.0005847,
0
],
[
0.00081183,
0.0005847,
0
],
[
-0.00174888,
0.00485646,
0
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[
0.00174888,
0.00485646,
0
],
[
0,
-0.00968536,
0
],
[
0,
-0.0010063,
0
],
[
0,
0.00559497,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-105
| 105 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25166471,
-6.82974601,
0
],
[
3.25166471,
6.82974601,
0
],
[
0,
0,
4.99276494
]
] |
agm005266167
|
[
[
3.25166471,
-2.8075557349952964,
2.49638247
],
[
1.76361413574077,
0.8861408995908924,
2.49638247
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[
4.73971528425923,
0.8861408995908935,
2.49638247
],
[
1.5708495011855506,
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0
],
[
4.932479918814449,
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0
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[
3.25166471,
2.7905112842578204,
0
],
[
3.25166471,
-5.246386596023032,
0
],
[
3.2516647100000005,
5.46856356093022,
2.49638247
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.04484522,
0,
0
],
[
0,
-0.0287708,
0
],
[
0,
0,
-0.05172036
]
] | -16.734878 | -16.734878 |
[
[
0,
-0.0022522,
0
],
[
-0.00204186,
0.00183411,
0
],
[
0.00204186,
0.00183411,
0
],
[
-0.00139143,
0.00670296,
0
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[
0.00139143,
0.00670296,
0
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[
0,
-0.0083995,
0
],
[
0,
-0.00171996,
0
],
[
0,
-0.00470249,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-106
| 106 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25150147,
-6.82916804,
0
],
[
3.25150147,
6.82916804,
0
],
[
0,
0,
4.99303961
]
] |
agm005266167
|
[
[
3.2515014700000004,
-2.807084450332936,
2.496519805
],
[
1.7632029198169716,
0.8860827093146293,
2.496519805
],
[
4.739800020183028,
0.8860827093146293,
2.496519805
],
[
1.5708881832117048,
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0
],
[
4.9321147567882955,
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0
],
[
3.25150147,
2.7905181179181437,
0
],
[
3.2515014699999996,
-5.245856570932262,
0
],
[
3.25150147,
5.467315700383959,
2.496519805
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.00934073,
0,
0
],
[
0,
0.01386415,
0
],
[
0,
0,
-0.02116505
]
] | -16.734878 | -16.734878 |
[
[
0,
-0.00394268,
0
],
[
-0.00138091,
0.0018004,
0
],
[
0.00138091,
0.0018004,
0
],
[
-0.0016553,
0.0063856,
0
],
[
0.0016553,
0.0063856,
0
],
[
0,
-0.00832409,
0
],
[
0,
-0.00078115,
0
],
[
0,
-0.00332408,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-107
| 107 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25154238,
-6.83005314,
0
],
[
3.25154238,
6.83005314,
0
],
[
0,
0,
4.99239736
]
] |
agm005266167
|
[
[
3.25154238,
-2.8084999564287734,
2.49619868
],
[
1.7632334281723037,
0.8865628220425796,
2.49619868
],
[
4.739851331827696,
0.8865628220425803,
2.49619868
],
[
1.5704483749376947,
-0.9873532332242454,
0
],
[
4.932636385062306,
-0.9873532332242458,
0
],
[
3.25154238,
2.7888925130765867,
0
],
[
3.25154238,
-5.2467819366431705,
0
],
[
3.25154238,
5.468052026395306,
2.49619868
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.01515924,
0,
0
],
[
0,
0.08004138,
0
],
[
0,
0,
0.02226528
]
] | -16.734917 | -16.734917 |
[
[
0,
0.00186949,
0
],
[
-0.00137138,
-0.00013458,
0
],
[
0.00137138,
-0.00013458,
0
],
[
0.00115523,
0.00237424,
0
],
[
-0.00115523,
0.00237424,
0
],
[
0,
-0.00724047,
0
],
[
0,
0.00027753,
0
],
[
0,
0.00061413,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-108
| 108 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25155045,
-6.83022773,
0
],
[
3.25155045,
6.83022773,
0
],
[
0,
0,
4.99227068
]
] |
agm005266167
|
[
[
3.25155045,
-2.80877911309323,
2.49613534
],
[
1.7632394301149295,
0.8866574749852878,
2.49613534
],
[
4.739861469885071,
0.886657474985288,
2.49613534
],
[
1.570361586890001,
-0.9871293735685371,
0
],
[
4.932739313109998,
-0.9871293735685382,
0
],
[
3.25155045,
2.7885718843540257,
0
],
[
3.25155045,
-5.246964413034894,
0
],
[
3.25155045,
5.468197401673358,
2.49613534
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.00714789,
0,
0
],
[
0,
0.06555845,
0
],
[
0,
0,
0.00402848
]
] | -16.734921 | -16.734921 |
[
[
0,
0.00303877,
0
],
[
-0.00132325,
-0.0001979,
0
],
[
0.00132325,
-0.0001979,
0
],
[
0.00176312,
0.00176466,
0
],
[
-0.00176312,
0.00176466,
0
],
[
0,
-0.00684963,
0
],
[
0,
0.00081555,
0
],
[
0,
-0.0001382,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-109
| 109 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43509487,
-5.83547984,
0
],
[
3.43509487,
5.83547984,
0
],
[
0,
0,
5.24890836
]
] |
agm005266167
|
[
[
3.4350948700000004,
-1.9213562463353282,
2.62445418
],
[
1.6760777330952068,
0.9469137434498622,
2.62445418
],
[
5.194112006904794,
0.9469137434498625,
2.62445418
],
[
1.5005251143559861,
-0.9657452453771311,
0
],
[
5.369664625644013,
-0.9657452453771311,
0
],
[
3.4350948700000004,
1.9975594433739516,
0
],
[
3.43509487,
-4.108672305921642,
0
],
[
3.4350948700000004,
4.070202138495635,
2.62445418
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.15508754,
0,
0
],
[
0,
0.33665545,
0
],
[
0,
0,
0.27308455
]
] | -16.626595 | -16.626595 |
[
[
0,
-0.01921641,
0
],
[
0.02155107,
-0.00788229,
0
],
[
-0.02155107,
-0.00788229,
0
],
[
-0.00662143,
0.00221762,
0
],
[
0.00662143,
0.00221762,
0
],
[
0,
0.00299045,
0
],
[
0,
0.01130394,
0
],
[
0,
0.01625135,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-11
| 11 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25156659,
-6.83057691,
0
],
[
3.25156659,
6.83057691,
0
],
[
0,
0,
4.99201731
]
] |
agm005266167
|
[
[
3.25156659,
-2.8093375948369967,
2.496008655
],
[
1.7632514665400567,
0.8868469968290824,
2.496008655
],
[
4.739881713459943,
0.8868469968290826,
2.496008655
],
[
1.5701880744755117,
-0.9866816160533372,
0
],
[
4.932945105524488,
-0.9866816160533363,
0
],
[
3.25156659,
2.7879304301895185,
0
],
[
3.2515665900000004,
-5.247329509846461,
0
],
[
3.2515665900000004,
5.468487879865369,
2.496008655
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.01362263,
0,
0
],
[
0,
0.0716784,
0
],
[
0,
0,
0.00419211
]
] | -16.734925 | -16.734925 |
[
[
0,
0.00444929,
0
],
[
-0.00125568,
-0.00064015,
0
],
[
0.00125568,
-0.00064015,
0
],
[
0.00306258,
0.00028962,
0
],
[
-0.00306258,
0.00028962,
0
],
[
0,
-0.00634874,
0
],
[
0,
0.00152791,
0
],
[
0,
0.0010726,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-110
| 110 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25159887,
-6.83127526,
0
],
[
3.25159887,
6.83127526,
0
],
[
0,
0,
4.99151057
]
] |
agm005266167
|
[
[
3.25159887,
-2.810454544840084,
2.495755285
],
[
1.763275506972131,
0.887225878506783,
2.495755285
],
[
4.739922233027869,
0.8872258785067828,
2.495755285
],
[
1.569841044246735,
-0.9857859467647532,
0
],
[
4.933356695753265,
-0.9857859467647536,
0
],
[
3.25159887,
2.786647550558984,
0
],
[
3.25159887,
-5.248059588869927,
0
],
[
3.2515988699999996,
5.469068831595591,
2.495755285
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.0219733,
0,
0
],
[
0,
0.09606581,
0
],
[
0,
0,
0.0058722
]
] | -16.734923 | -16.734923 |
[
[
0,
0.00775046,
0
],
[
-0.0011403,
-0.00135469,
0
],
[
0.0011403,
-0.00135469,
0
],
[
0.00558972,
-0.00252231,
0
],
[
-0.00558972,
-0.00252231,
0
],
[
0,
-0.00438024,
0
],
[
0,
0.00318738,
0
],
[
0,
0.00119643,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-111
| 111 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25157814,
-6.83082689,
0
],
[
3.25157814,
6.83082689,
0
],
[
0,
0,
4.99183592
]
] |
agm005266167
|
[
[
3.25157814,
-2.809737413084405,
2.49591796
],
[
1.7632600709816733,
0.8869825984334245,
2.49591796
],
[
4.739896209018326,
0.8869825984334234,
2.49591796
],
[
1.5700638489944938,
-0.9863608834425892,
0
],
[
4.933092431005505,
-0.9863608834425897,
0
],
[
3.2515781400000003,
2.7874711032876096,
0
],
[
3.25157814,
-5.247590812006891,
0
],
[
3.25157814,
5.468695798361234,
2.49591796
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.01873101,
0,
0
],
[
0,
0.08523367,
0
],
[
0,
0,
0.00031017
]
] | -16.734925 | -16.734925 |
[
[
0,
0.00433875,
0
],
[
-0.00130796,
-0.00059781,
0
],
[
0.00130796,
-0.00059781,
0
],
[
0.00399807,
-0.00065287,
0
],
[
-0.00399807,
-0.00065287,
0
],
[
0,
-0.00437223,
0
],
[
0,
0.00260411,
0
],
[
0,
-0.00006926,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-112
| 112 | 1 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25157814,
-6.83082689,
0
],
[
3.25157814,
6.83082689,
0
],
[
0,
0,
4.99183592
]
] |
agm005266167
|
[
[
3.25157814,
-2.809737413084405,
2.49591796
],
[
1.7632600709816733,
0.8869825984334245,
2.49591796
],
[
4.739896209018326,
0.8869825984334234,
2.49591796
],
[
1.5700638489944938,
-0.9863608834425892,
0
],
[
4.933092431005505,
-0.9863608834425897,
0
],
[
3.2515781400000003,
2.7874711032876096,
0
],
[
3.25157814,
-5.247590812006891,
0
],
[
3.25157814,
5.468695798361234,
2.49591796
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.13795945,
0,
0
],
[
0,
0.55321816,
0
],
[
0,
0,
0.23659687
]
] | -16.754743 | -16.754743 |
[
[
0,
0.01368218,
0
],
[
0.00031487,
0.00072452,
0
],
[
-0.00031487,
0.00072452,
0
],
[
0.00875899,
0.00892056,
0
],
[
-0.00875899,
0.00892056,
0
],
[
0,
-0.01363336,
0
],
[
0,
0.00087568,
0
],
[
0,
-0.02021465,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-113
| 113 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25120375,
-6.83398086,
0
],
[
3.25120375,
6.83398086,
0
],
[
0,
0,
4.99282165
]
] |
agm005266167
|
[
[
3.25120375,
-2.810374442515592,
2.496410825
],
[
1.7630722305529125,
0.8874270629539605,
2.496410825
],
[
4.739335269447087,
0.8874270629539591,
2.496410825
],
[
1.5703055966922252,
-0.9863857710592956,
0
],
[
4.9321019033077755,
-0.9863857710592949,
0
],
[
3.25120375,
2.78810017533936,
0
],
[
3.25120375,
-5.249971526831119,
0
],
[
3.2512037499999997,
5.470245217988341,
2.496410825
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.22351263,
0,
0
],
[
0,
0.36605652,
0
],
[
0,
0,
0.05552219
]
] | -16.754828 | -16.754828 |
[
[
0,
0.00978053,
0
],
[
-0.00259023,
-0.00113326,
0
],
[
0.00259023,
-0.00113326,
0
],
[
0.00678309,
0.0087017,
0
],
[
-0.00678309,
0.0087017,
0
],
[
0,
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0
],
[
0,
0.00042477,
0
],
[
0,
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0
]
] |
pbe
| true | 38 |
agm005266167-pbe-114
| 114 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.25076257,
-6.83769739,
0
],
[
3.25076257,
6.83769739,
0
],
[
0,
0,
4.99398319
]
] |
agm005266167
|
[
[
3.25076257,
-2.8111245442768324,
2.496991595
],
[
1.7628508978804391,
0.8879509045325289,
2.496991595
],
[
4.7386742421195605,
0.8879509045325289,
2.496991595
],
[
1.570590332035164,
-0.9864148409801112,
0
],
[
4.930934807964835,
-0.9864148409801112,
0
],
[
3.25076257,
2.788841035498614,
0
],
[
3.25076257,
-5.252776845163971,
0
],
[
3.25076257,
5.472070279206036,
2.496991595
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.30219546,
0,
0
],
[
0,
0.17602466,
0
],
[
0,
0,
-0.12892907
]
] | -16.754902 | -16.754902 |
[
[
0,
0.00582106,
0
],
[
-0.00594255,
-0.00249237,
0
],
[
0.00594255,
-0.00249237,
0
],
[
0.00485309,
0.00917226,
0
],
[
-0.00485309,
0.00917226,
0
],
[
0,
-0.01235391,
0
],
[
0,
0.00063203,
0
],
[
0,
-0.00745896,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-115
| 115 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24988022,
-6.84513043,
0
],
[
3.24988022,
6.84513043,
0
],
[
0,
0,
4.99630628
]
] |
agm005266167
|
[
[
3.24988022,
-2.812623159807029,
2.49815314
],
[
1.7624081908742748,
0.8889986511049546,
2.49815314
],
[
4.737352249125726,
0.8889986511049548,
2.49815314
],
[
1.5711596296733408,
-0.9864718024994599,
0
],
[
4.9286008103266585,
-0.9864718024994596,
0
],
[
3.24988022,
2.790320903450437,
0
],
[
3.2498802200000005,
-5.258387304127769,
0
],
[
3.24988022,
5.475718004838531,
2.49815314
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.4614016,
0,
0
],
[
0,
-0.19388556,
0
],
[
0,
0,
-0.49114524
]
] | -16.754962 | -16.754962 |
[
[
0,
-0.00257582,
0
],
[
-0.012736,
-0.00444429,
0
],
[
0.012736,
-0.00444429,
0
],
[
0.00105077,
0.01080857,
0
],
[
-0.00105077,
0.01080857,
0
],
[
0,
-0.01073421,
0
],
[
0,
0.00151798,
0
],
[
0,
-0.00093651,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-116
| 116 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24838613,
-6.84695511,
0
],
[
3.24838613,
6.84695511,
0
],
[
0,
0,
4.99530237
]
] |
agm005266167
|
[
[
3.24838613,
-2.8128925275369245,
2.497651185
],
[
1.7610453312704704,
0.8890693839742252,
2.497651185
],
[
4.73572692872953,
0.8890693839742259,
2.497651185
],
[
1.5708646672262643,
-0.9858658838771133,
0
],
[
4.925907592773736,
-0.9858658838771133,
0
],
[
3.24838613,
2.789994255562552,
0
],
[
3.24838613,
-5.25968343208893,
0
],
[
3.24838613,
5.476256867330399,
2.497651185
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.27876686,
0,
0
],
[
0,
-0.11060739,
0
],
[
0,
0,
-0.34596307
]
] | -16.755032 | -16.755032 |
[
[
0,
-0.00488408,
0
],
[
-0.01288953,
-0.00413596,
0
],
[
0.01288953,
-0.00413596,
0
],
[
0.00099073,
0.00977364,
0
],
[
-0.00099073,
0.00977364,
0
],
[
0,
-0.00892835,
0
],
[
0,
0.00344204,
0
],
[
0,
-0.00090497,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-117
| 117 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24390387,
-6.85242915,
0
],
[
3.24390387,
6.85242915,
0
],
[
0,
0,
4.99229061
]
] |
agm005266167
|
[
[
3.24390387,
-2.81369923154061,
2.496145305
],
[
1.7569591591895626,
0.8892811879918572,
2.496145305
],
[
4.730848580810438,
0.8892811879918581,
2.496145305
],
[
1.56997810719486,
-0.984045966105993,
0
],
[
4.917829632805141,
-0.9840459661059926,
0
],
[
3.2439038700000005,
2.7890114368475736,
0
],
[
3.24390387,
-5.263571341285047,
0
],
[
3.24390387,
5.477871058404738,
2.496145305
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.13749575,
0,
0
],
[
0,
0.04724676,
0
],
[
0,
0,
-0.03739998
]
] | -16.75516 | -16.75516 |
[
[
0,
-0.01336537,
0
],
[
-0.01231544,
-0.00233344,
0
],
[
0.01231544,
-0.00233344,
0
],
[
0.00050896,
0.00594139,
0
],
[
-0.00050896,
0.00594139,
0
],
[
0,
-0.004263,
0
],
[
0,
0.00931271,
0
],
[
0,
0.00109976,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-118
| 118 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24228544,
-6.85440568,
0
],
[
3.24228544,
6.85440568,
0
],
[
0,
0,
4.99120314
]
] |
agm005266167
|
[
[
3.24228544,
-2.813990434764886,
2.49560157
],
[
1.7554840288409217,
0.8893576290107505,
2.49560157
],
[
4.729086851159078,
0.8893576290107505,
2.49560157
],
[
1.5696577886182976,
-0.983388628082865,
0
],
[
4.9149130913817025,
-0.9833886280828645,
0
],
[
3.24228544,
2.7886561401072654,
0
],
[
3.24228544,
-5.26497524609604,
0
],
[
3.24228544,
5.478453517589823,
2.49560157
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.32522732,
0,
0
],
[
0,
0.12176654,
0
],
[
0,
0,
0.10800778
]
] | -16.755169 | -16.755169 |
[
[
0,
-0.01707919,
0
],
[
-0.01245341,
-0.00214861,
0
],
[
0.01245341,
-0.00214861,
0
],
[
0.00017874,
0.00463022,
0
],
[
-0.00017874,
0.00463022,
0
],
[
0,
-0.00259966,
0
],
[
0,
0.01120936,
0
],
[
0,
0.00350627,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-119
| 119 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43357027,
-5.83896204,
0
],
[
3.43357027,
5.83896204,
0
],
[
0,
0,
5.24090205
]
] |
agm005266167
|
[
[
3.43357027,
-1.9224782516700003,
2.620451025
],
[
1.6802625227236316,
0.9420952713321744,
2.620451025
],
[
5.186878017276369,
0.9420952713321751,
2.620451025
],
[
1.5014257362604384,
-0.9679264306697914,
0
],
[
5.365714803739562,
-0.9679264306697917,
0
],
[
3.4335702700000006,
1.9996664103577801,
0
],
[
3.43357027,
-4.111484333761137,
0
],
[
3.43357027,
4.086028561293072,
2.620451025
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.42596416,
0,
0
],
[
0,
0.34938674,
0
],
[
0,
0,
1.11059075
]
] | -16.626782 | -16.626782 |
[
[
0,
-0.05387808,
0
],
[
0.0055092,
0.01086456,
0
],
[
-0.0055092,
0.01086456,
0
],
[
-0.01301709,
0.00697886,
0
],
[
0.01301709,
0.00697886,
0
],
[
0,
0.00463984,
0
],
[
0,
0.00068257,
0
],
[
0,
0.01286884,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-12
| 12 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24214555,
-6.85755245,
0
],
[
3.24214555,
6.85755245,
0
],
[
0,
0,
4.99087071
]
] |
agm005266167
|
[
[
3.24214555,
-2.8161425131701545,
2.495435355
],
[
1.753803101357272,
0.8894120720195411,
2.495435355
],
[
4.730487998642728,
0.8894120720195406,
2.495435355
],
[
1.5700676978434107,
-0.9825242620632635,
0
],
[
4.91422340215659,
-0.9825242620632633,
0
],
[
3.24214555,
2.7885662375029696,
0
],
[
3.2421455499999996,
-5.266371650801316,
0
],
[
3.2421455499999996,
5.480254460034297,
2.495435355
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.16841249,
0,
0
],
[
0,
0.10142006,
0
],
[
0,
0,
0.08898233
]
] | -16.755239 | -16.755239 |
[
[
0,
-0.01285454,
0
],
[
-0.00662478,
-0.00176425,
0
],
[
0.00662478,
-0.00176425,
0
],
[
-0.00122655,
0.00258332,
0
],
[
0.00122655,
0.00258332,
0
],
[
0,
-0.00126889,
0
],
[
0,
0.00874921,
0
],
[
0,
0.00373608,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-120
| 120 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.2419987,
-6.86085588,
0
],
[
3.2419987,
6.86085588,
0
],
[
0,
0,
4.99052174
]
] |
agm005266167
|
[
[
3.2419987,
-2.8184021352308952,
2.49526087
],
[
1.752038538374962,
0.8894690741409554,
2.49526087
],
[
4.731958861625037,
0.8894690741409548,
2.49526087
],
[
1.570497990590399,
-0.9816162003368529,
0
],
[
4.913499409409601,
-0.9816162003368527,
0
],
[
3.2419987,
2.7884712398030422,
0
],
[
3.2419987,
-5.267836909216505,
0
],
[
3.2419987000000003,
5.482144524523831,
2.49526087
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.01574308,
0,
0
],
[
0,
0.08553755,
0
],
[
0,
0,
0.081079
]
] | -16.75528 | -16.75528 |
[
[
0,
-0.00911902,
0
],
[
-0.00100779,
-0.00121599,
0
],
[
0.00100779,
-0.00121599,
0
],
[
-0.00247202,
0.00099023,
0
],
[
0.00247202,
0.00099023,
0
],
[
0,
0.00024507,
0
],
[
0,
0.00662065,
0
],
[
0,
0.00270481,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-121
| 121 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24170499,
-6.86746274,
0
],
[
3.24170499,
6.86746274,
0
],
[
0,
0,
4.98982378
]
] |
agm005266167
|
[
[
3.24170499,
-2.822923164041588,
2.49491189
],
[
1.7485097677435535,
0.8895823486707193,
2.49491189
],
[
4.734900212256447,
0.8895823486707188,
2.49491189
],
[
1.5713584349661291,
-0.9797974597010035,
0
],
[
4.912051545033871,
-0.979797459701004,
0
],
[
3.24170499,
2.7882783253600913,
0
],
[
3.24170499,
-5.270765703564832,
0
],
[
3.2417049900000006,
5.485923311209032,
2.49491189
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.287461,
0,
0
],
[
0,
0.05902687,
0
],
[
0,
0,
0.06190061
]
] | -16.755258 | -16.755258 |
[
[
0,
-0.00188798,
0
],
[
0.01010792,
-0.00033608,
0
],
[
-0.01010792,
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0
],
[
-0.00506421,
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0
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[
0.00506421,
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0
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[
0,
0.00340149,
0
],
[
0,
0.00221517,
0
],
[
0,
0.00209494,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-122
| 122 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.24189869,
-6.86310545,
0
],
[
3.24189869,
6.86310545,
0
],
[
0,
0,
4.99028409
]
] |
agm005266167
|
[
[
3.24189869,
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2.495142045
],
[
1.7508371506793916,
0.8895074002618588,
2.495142045
],
[
4.732960229320609,
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2.495142045
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[
1.5707909154012285,
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0
],
[
4.913006464598772,
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0
],
[
3.24189869,
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0
],
[
3.24189869,
-5.268833231862582,
0
],
[
3.2418986899999997,
5.483430460218489,
2.495142045
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.10797936,
0,
0
],
[
0,
0.05489965,
0
],
[
0,
0,
0.05714532
]
] | -16.755288 | -16.755288 |
[
[
0,
-0.00636416,
0
],
[
0.002721,
-0.00060503,
0
],
[
-0.002721,
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0
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[
-0.00319098,
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0
],
[
0.00319098,
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0
],
[
0,
0.0015368,
0
],
[
0,
0.00539829,
0
],
[
0,
0.00037408,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-123
| 123 | 2 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43398987,
-5.83800366,
0
],
[
3.43398987,
5.83800366,
0
],
[
0,
0,
5.24310555
]
] |
agm005266167
|
[
[
3.4339898700000004,
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2.621552775
],
[
1.6791106093157808,
0.9434211579358537,
2.621552775
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[
5.188869130684219,
0.9434211579358536,
2.621552775
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[
1.5011778060835541,
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0
],
[
5.366801933916445,
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0
],
[
3.43398987,
1.9990865764806238,
0
],
[
3.43398987,
-4.110710481353896,
0
],
[
3.4339898700000004,
4.081673418749789,
2.621552775
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.32012778,
0,
0
],
[
0,
0.31215671,
0
],
[
0,
0,
0.84187636
]
] | -16.626794 | -16.626794 |
[
[
0,
-0.04539105,
0
],
[
0.00983544,
0.00466267,
0
],
[
-0.00983544,
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0
],
[
-0.01133821,
0.00465739,
0
],
[
0.01133821,
0.00465739,
0
],
[
0,
0.00317131,
0
],
[
0,
0.00256586,
0
],
[
0,
0.02101375,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-13
| 13 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43464239,
-5.84103889,
0
],
[
3.43464239,
5.84103889,
0
],
[
0,
0,
5.2451179
]
] |
agm005266167
|
[
[
3.43464239,
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2.62255895
],
[
1.681658650482576,
0.9424591598416683,
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5.187626129517424,
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[
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0
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[
5.36803412134814,
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0
],
[
3.4346423899999996,
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0
],
[
3.4346423900000005,
-4.112801298426691,
0
],
[
3.4346423900000005,
4.089487492621922,
2.62255895
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.08493808,
0,
0
],
[
0,
0.14608899,
0
],
[
0,
0,
0.56742726
]
] | -16.627087 | -16.627087 |
[
[
0,
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0
],
[
0.00615548,
0.00718566,
0
],
[
-0.00615548,
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0
],
[
-0.00908563,
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0
],
[
0.00908563,
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0
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[
0,
0.00457142,
0
],
[
0,
-0.00204175,
0
],
[
0,
0.01195135,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-14
| 14 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43609957,
-5.84781699,
0
],
[
3.43609957,
5.84781699,
0
],
[
0,
0,
5.24961175
]
] |
agm005266167
|
[
[
3.4360995699999997,
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2.624805875
],
[
1.6873508124167276,
0.9403070426782877,
2.624805875
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5.184848327583273,
0.9403070426782869,
2.624805875
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[
1.5014131907463133,
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0
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5.370785949253687,
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0
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[
3.4360995699999997,
2.004062554622533,
0
],
[
3.43609957,
-4.117470281319902,
0
],
[
3.4360995699999997,
4.106952163769009,
2.624805875
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.46046732,
0,
0
],
[
0,
-0.24266326,
0
],
[
0,
0,
-0.06649614
]
] | -16.627548 | -16.627548 |
[
[
0,
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0
],
[
-0.00254321,
0.00957752,
0
],
[
0.00254321,
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0
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[
-0.00490036,
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0
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[
0.00490036,
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0
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[
0,
0.00566584,
0
],
[
0,
-0.01523396,
0
],
[
0,
0.01364438,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-15
| 15 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43901392,
-5.86137319,
0
],
[
3.43901392,
5.86137319,
0
],
[
0,
0,
5.25859946
]
] |
agm005266167
|
[
[
3.43901392,
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2.62929973
],
[
1.6987436039467472,
0.9359878554369293,
2.62929973
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[
5.1792842360532525,
0.9359878554369292,
2.62929973
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[
1.5017373530100815,
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0
],
[
5.376290486989918,
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0
],
[
3.43901392,
2.0109424216982497,
0
],
[
3.4390139199999994,
-4.126807878141124,
0
],
[
3.43901392,
4.141940419760674,
2.62929973
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-1.54759046,
0,
0
],
[
0,
-1.00406844,
0
],
[
0,
0,
-1.30442714
]
] | -16.627622 | -16.627622 |
[
[
0,
-0.04975034,
0
],
[
-0.01654941,
0.01371027,
0
],
[
0.01654941,
0.01371027,
0
],
[
0.00456982,
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0
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[
-0.00456982,
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0
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[
0,
0.00713936,
0
],
[
0,
-0.04052139,
0
],
[
0,
0.01248942,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-16
| 16 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.4379323,
-5.85634201,
0
],
[
3.4379323,
5.85634201,
0
],
[
0,
0,
5.25526381
]
] |
agm005266167
|
[
[
3.4379323,
-1.94566433579316,
2.627631905
],
[
1.694516503724121,
0.9375888188072402,
2.627631905
],
[
5.181348096275879,
0.9375888188072401,
2.627631905
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[
1.501616907096284,
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0
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[
5.374247692903715,
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0
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[
3.4379323,
2.0083897410328273,
0
],
[
3.4379323,
-4.123342301167495,
0
],
[
3.4379323,
4.1289632182286935,
2.627631905
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-1.16740531,
0,
0
],
[
0,
-0.75793034,
0
],
[
0,
0,
-0.87404248
]
] | -16.627709 | -16.627709 |
[
[
0,
-0.04875506,
0
],
[
-0.01171436,
0.01271714,
0
],
[
0.01171436,
0.01271714,
0
],
[
0.00112968,
0.01859199,
0
],
[
-0.00112968,
0.01859199,
0
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[
0,
0.00711126,
0
],
[
0,
-0.03071242,
0
],
[
0,
0.00973796,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-17
| 17 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43693715,
-5.8571058,
0
],
[
3.43693715,
5.8571058,
0
],
[
0,
0,
5.25514396
]
] |
agm005266167
|
[
[
3.43693715,
-1.9493497695759365,
2.62757198
],
[
1.6955460257861894,
0.9368371027540981,
2.62757198
],
[
5.17832827421381,
0.9368371027540983,
2.62757198
],
[
1.5010377231876646,
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0
],
[
5.372836576812336,
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0
],
[
3.43693715,
2.0092154822419674,
0
],
[
3.43693715,
-4.124547313099668,
0
],
[
3.4369371500000003,
4.134292951440288,
2.62757198
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-1.10539784,
0,
0
],
[
0,
-0.59867857,
0
],
[
0,
0,
-0.83440013
]
] | -16.627936 | -16.627936 |
[
[
0,
-0.04430533,
0
],
[
-0.0108983,
0.01104229,
0
],
[
0.0108983,
0.01104229,
0
],
[
0.0051434,
0.01887463,
0
],
[
-0.0051434,
0.01887463,
0
],
[
0,
0.00786453,
0
],
[
0,
-0.03211897,
0
],
[
0,
0.00872592,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-18
| 18 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43395172,
-5.85939718,
0
],
[
3.43395172,
5.85939718,
0
],
[
0,
0,
5.25478439
]
] |
agm005266167
|
[
[
3.43395172,
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2.627392195
],
[
1.698630659726244,
0.9345809986745597,
2.627392195
],
[
5.169272780273756,
0.9345809986745599,
2.627392195
],
[
1.4993005449886447,
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0
],
[
5.368602895011355,
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0
],
[
3.4339517199999996,
2.0116933571958855,
0
],
[
3.43395172,
-4.128163165697153,
0
],
[
3.4339517200000005,
4.150287780697058,
2.627392195
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.97382698,
0,
0
],
[
0,
-0.18154491,
0
],
[
0,
0,
-0.79052852
]
] | -16.628565 | -16.628565 |
[
[
0,
-0.03240558,
0
],
[
-0.00776342,
0.00559219,
0
],
[
0.00776342,
0.00559219,
0
],
[
0.01716593,
0.01878286,
0
],
[
-0.01716593,
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0
],
[
0,
0.00951954,
0
],
[
0,
-0.03735403,
0
],
[
0,
0.01148999,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-19
| 19 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43963631,
-5.82092199,
0
],
[
3.43963631,
5.82092199,
0
],
[
0,
0,
5.24764286
]
] |
agm005266167
|
[
[
3.43963631,
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2.62382143
],
[
1.686739516570361,
0.9501866995837556,
2.62382143
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5.192533103429639,
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2.62382143
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[
1.4919015241685898,
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0
],
[
5.38737109583141,
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0
],
[
3.43963631,
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0
],
[
3.43963631,
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0
],
[
3.43963631,
3.9994450182296295,
2.62382143
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.02160453,
0,
0
],
[
0,
0.41870862,
0
],
[
0,
0,
0.29289642
]
] | -16.624412 | -16.624412 |
[
[
0,
-0.00712597,
0
],
[
-0.01324196,
0.00210768,
0
],
[
0.01324196,
0.00210768,
0
],
[
0.00580476,
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0
],
[
-0.00580476,
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0
],
[
0,
0.00186722,
0
],
[
0,
-0.02113151,
0
],
[
0,
0.04171622,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-2
| 2 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.42798084,
-5.86397994,
0
],
[
3.42798084,
5.86397994,
0
],
[
0,
0,
5.25406526
]
] |
agm005266167
|
[
[
3.42798084,
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2.62703263
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[
1.7047839946974372,
0.9300646893158168,
2.62703263
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[
5.151177685302564,
0.9300646893158162,
2.62703263
],
[
1.4958276518163132,
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0
],
[
5.360134028183687,
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0
],
[
3.42798084,
2.016651786706502,
0
],
[
3.42798084,
-4.135397927039979,
0
],
[
3.4279808399999996,
4.18229991507368,
2.62703263
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.69415863,
0,
0
],
[
0,
0.72998772,
0
],
[
0,
0,
-0.70774408
]
] | -16.629502 | -16.629502 |
[
[
0,
-0.00582352,
0
],
[
0.0045301,
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0
],
[
-0.0045301,
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0
],
[
0.04160265,
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0
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[
-0.04160265,
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0
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[
0,
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0
],
[
0,
-0.04396846,
0
],
[
0,
-0.00298032,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-20
| 20 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.41603908,
-5.87314545,
0
],
[
3.41603908,
5.87314545,
0
],
[
0,
0,
5.25262699
]
] |
agm005266167
|
[
[
3.41603908,
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2.626313495
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[
1.7170271909688797,
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[
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0
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5.343190284979151,
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0
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[
3.41603908,
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0
],
[
3.41603908,
-4.149879884212611,
0
],
[
3.4160390799999996,
4.246413956864445,
2.626313495
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.10659276,
0,
0
],
[
0,
2.71123838,
0
],
[
0,
0,
-0.36187215
]
] | -16.629822 | -16.629822 |
[
[
0,
0.04844646,
0
],
[
0.03188635,
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0
],
[
-0.03188635,
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0
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[
0.09003185,
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0
],
[
-0.09003185,
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0
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[
0,
0.03105203,
0
],
[
0,
-0.06130023,
0
],
[
0,
-0.02329114,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-21
| 21 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.41998693,
-5.8701154,
0
],
[
3.41998693,
5.8701154,
0
],
[
0,
0,
5.25310247
]
] |
agm005266167
|
[
[
3.4199869300000003,
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2.626551235
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[
1.7129727182143308,
0.9240054142282061,
2.626551235
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2.626551235
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0
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[
5.348791056181792,
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0
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[
3.41998693,
2.02329846181812,
0
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[
3.41998693,
-4.145093585772076,
0
],
[
3.4199869300000003,
4.225228174729788,
2.626551235
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.2236022,
0,
0
],
[
0,
2.00573669,
0
],
[
0,
0,
-0.51052219
]
] | -16.629924 | -16.629924 |
[
[
0,
0.02865688,
0
],
[
0.02358948,
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0
],
[
-0.02358948,
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0
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[
0.07415529,
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0
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[
-0.07415529,
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0
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[
0,
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0
],
[
0,
-0.05408417,
0
],
[
0,
-0.02174562,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-22
| 22 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.41832331,
-5.87370528,
0
],
[
3.41832331,
5.87370528,
0
],
[
0,
0,
5.25236781
]
] |
agm005266167
|
[
[
3.41832331,
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2.626183905
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[
1.7147466483568103,
0.9230389228075393,
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[
5.12189997164319,
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[
1.4911652985669341,
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0
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[
5.345481321433066,
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0
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[
3.41832331,
2.02573628164391,
0
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[
3.41832331,
-4.149321444806285,
0
],
[
3.41832331,
4.234832608384109,
2.626183905
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.17866682,
0,
0
],
[
0,
2.13005207,
0
],
[
0,
0,
-0.40697569
]
] | -16.630274 | -16.630274 |
[
[
0,
0.03151443,
0
],
[
0.0248826,
-0.01796441,
0
],
[
-0.0248826,
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0
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[
0.07558516,
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0
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[
-0.07558516,
0.02545191,
0
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[
0,
0.03082023,
0
],
[
0,
-0.05630877,
0
],
[
0,
-0.02100088,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-23
| 23 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.41473573,
-5.88144682,
0
],
[
3.41473573,
5.88144682,
0
],
[
0,
0,
5.25078353
]
] |
agm005266167
|
[
[
3.41473573,
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2.625391765
],
[
1.7185662859423911,
0.920950232064601,
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5.110905174057608,
0.9209502320646008,
2.625391765
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[
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0
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5.338345491311554,
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0
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[
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0
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[
3.41473573,
-4.158443802720935,
0
],
[
3.4147357299999994,
4.255564486946404,
2.625391765
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-0.10370626,
0,
0
],
[
0,
2.36388595,
0
],
[
0,
0,
-0.23635883
]
] | -16.631117 | -16.631117 |
[
[
0,
0.03533545,
0
],
[
0.02852562,
-0.02271728,
0
],
[
-0.02852562,
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0
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[
0.07989606,
0.02516298,
0
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[
-0.07989606,
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0
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[
0,
0.03713128,
0
],
[
0,
-0.06122193,
0
],
[
0,
-0.0161362,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-24
| 24 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.40756057,
-5.89692989,
0
],
[
3.40756057,
5.89692989,
0
],
[
0,
0,
5.24761496
]
] |
agm005266167
|
[
[
3.40756057,
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2.62380748
],
[
1.726181894867631,
0.916755531905749,
2.62380748
],
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5.0889392451323685,
0.9167555319057499,
2.62380748
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[
1.4910409628204107,
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0
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[
5.324080177179589,
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0
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[
3.4075605699999993,
2.041531516426931,
0
],
[
3.40756057,
-4.176707576831639,
0
],
[
3.4075605700000002,
4.297107906983519,
2.62380748
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.07476386,
0,
0
],
[
0,
2.84683908,
0
],
[
0,
0,
0.06132674
]
] | -16.633084 | -16.633084 |
[
[
0,
0.04534595,
0
],
[
0.03349496,
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0
],
[
-0.03349496,
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0
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[
0.08878519,
0.02583686,
0
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[
-0.08878519,
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0
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[
0,
0.05262743,
0
],
[
0,
-0.06716642,
0
],
[
0,
-0.02197304,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-25
| 25 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.39321026,
-5.92789603,
0
],
[
3.39321026,
5.92789603,
0
],
[
0,
0,
5.24127783
]
] |
agm005266167
|
[
[
3.39321026,
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2.620638915
],
[
1.7413183438306876,
0.9082967712061643,
2.620638915
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[
5.045102176169312,
0.9082967712061647,
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[
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0
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5.295575316857267,
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0
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[
3.39321026,
2.0626552900691224,
0
],
[
3.39321026,
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0
],
[
3.3932102599999996,
4.380512432125774,
2.620638915
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.46571382,
0,
0
],
[
0,
3.79403205,
0
],
[
0,
0,
0.57351129
]
] | -16.63693 | -16.63693 |
[
[
0,
0.0651064,
0
],
[
0.0253307,
-0.03783849,
0
],
[
-0.0253307,
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0
],
[
0.11004267,
0.02394542,
0
],
[
-0.11004267,
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0
],
[
0,
0.07460782,
0
],
[
0,
-0.08535567,
0
],
[
0,
-0.0265724,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-26
| 26 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.36450963,
-5.98982832,
0
],
[
3.36450963,
5.98982832,
0
],
[
0,
0,
5.22860356
]
] |
agm005266167
|
[
[
3.3645096300000006,
-2.217623003859513,
2.61430178
],
[
1.7712106664270961,
0.891103464760824,
2.61430178
],
[
4.957808593572905,
0.8911034647608242,
2.61430178
],
[
1.4903503184652156,
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0
],
[
5.238668941534785,
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0
],
[
3.3645096299999997,
2.105118933642547,
0
],
[
3.3645096299999997,
-4.286825249743411,
0
],
[
3.3645096300000006,
4.548586138172899,
2.61430178
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
1.68850865,
0,
0
],
[
0,
5.84088254,
0
],
[
0,
0,
1.39978169
]
] | -16.640746 | -16.640746 |
[
[
0,
0.12884297,
0
],
[
0.01731061,
-0.02907725,
0
],
[
-0.01731061,
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0
],
[
0.15326198,
0.02509265,
0
],
[
-0.15326198,
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0
],
[
0,
0.09672325,
0
],
[
0,
-0.14470528,
0
],
[
0,
-0.07289174,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-27
| 27 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.36218211,
-5.99890988,
0
],
[
3.36218211,
5.99890988,
0
],
[
0,
0,
5.22795172
]
] |
agm005266167
|
[
[
3.36218211,
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2.61397586
],
[
1.7745123108902492,
0.8896986842373931,
2.61397586
],
[
4.949851909109751,
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2.61397586
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[
1.4912813838856058,
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0
],
[
5.233082836114394,
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0
],
[
3.36218211,
2.1108361795192048,
0
],
[
3.36218211,
-4.296927603679231,
0
],
[
3.36218211,
4.567095228904098,
2.61397586
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
1.70084335,
0,
0
],
[
0,
5.83866107,
0
],
[
0,
0,
1.31677766
]
] | -16.641654 | -16.641654 |
[
[
0,
0.12815576,
0
],
[
0.01142224,
-0.02692391,
0
],
[
-0.01142224,
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0
],
[
0.15275586,
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0
],
[
-0.15275586,
0.02496688,
0
],
[
0,
0.09814175,
0
],
[
0,
-0.15212531,
0
],
[
0,
-0.07025814,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-28
| 28 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.35519955,
-6.02615457,
0
],
[
3.35519955,
6.02615457,
0
],
[
0,
0,
5.2259962
]
] |
agm005266167
|
[
[
3.35519955,
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2.6129981
],
[
1.7843890662774,
0.8854467545421971,
2.6129981
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[
4.9260100337226,
0.8854467545421976,
2.6129981
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[
1.494062374240071,
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0
],
[
5.216336725759929,
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0
],
[
3.35519955,
2.1280224715510356,
0
],
[
3.35519955,
-4.327283731966784,
0
],
[
3.35519955,
4.622780560138024,
2.6129981
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
1.8293813,
0,
0
],
[
0,
5.89824796,
0
],
[
0,
0,
1.05740217
]
] | -16.644056 | -16.644056 |
[
[
0,
0.13692317,
0
],
[
-0.00438246,
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0
],
[
0.00438246,
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0
],
[
0.15323559,
0.02716599,
0
],
[
-0.15323559,
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0
],
[
0,
0.10555481,
0
],
[
0,
-0.16894689,
0
],
[
0,
-0.07952862,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-29
| 29 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.4341773,
-5.83188837,
0
],
[
3.4341773,
5.83188837,
0
],
[
0,
0,
5.24604607
]
] |
agm005266167
|
[
[
3.4341773,
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2.623023035
],
[
1.682944033118793,
0.9527758396595439,
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[
5.185410566881208,
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[
1.488405718998037,
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0
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[
5.379948881001964,
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0
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[
3.4341773,
1.9909923430726097,
0
],
[
3.4341773,
-4.082293749298056,
0
],
[
3.4341773,
4.010135094669442,
2.623023035
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.49883942,
0,
0
],
[
0,
-0.10085666,
0
],
[
0,
0,
0.44356925
]
] | -16.624559 | -16.624559 |
[
[
0,
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0
],
[
-0.01145388,
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0
],
[
0.01145388,
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0
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[
0.01391725,
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0
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[
-0.01391725,
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0
],
[
0,
0.00570478,
0
],
[
0,
-0.01878997,
0
],
[
0,
0.03368601,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-3
| 3 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.34123444,
-6.08064394,
0
],
[
3.34123444,
6.08064394,
0
],
[
0,
0,
5.22208517
]
] |
agm005266167
|
[
[
3.34123444,
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2.611042585
],
[
1.8040294701917932,
0.8767937708324662,
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[
4.878439409808207,
0.8767937708324656,
2.611042585
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[
1.4995753861227274,
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0
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[
5.182893493877272,
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0
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[
3.34123444,
2.1625317640450863,
0
],
[
3.34123444,
-4.38819094928207,
0
],
[
3.3412344400000005,
4.734780235476464,
2.611042585
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
2.19957167,
0,
0
],
[
0,
6.18792897,
0
],
[
0,
0,
0.40630011
]
] | -16.645944 | -16.645944 |
[
[
0,
0.15718503,
0
],
[
-0.03391643,
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0
],
[
0.03391643,
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0
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[
0.15653469,
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0
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[
-0.15653469,
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0
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[
0,
0.12171359,
0
],
[
0,
-0.18626922,
0
],
[
0,
-0.11786643,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-30
| 30 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.3418114,
-6.0936622,
0
],
[
3.3418114,
6.0936622,
0
],
[
0,
0,
5.22225951
]
] |
agm005266167
|
[
[
3.3418114,
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2.611129755
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[
1.806037992891976,
0.8770968749262242,
2.611129755
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[
4.877584807108024,
0.8770968749262238,
2.611129755
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[
1.502937369817676,
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0
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[
5.180685430182324,
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0
],
[
3.3418114,
2.1700558485646915,
0
],
[
3.3418114,
-4.40188973200596,
0
],
[
3.3418114,
4.74883909239138,
2.611129755
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
1.67933519,
0,
0
],
[
0,
5.60367281,
0
],
[
0,
0,
0.06528639
]
] | -16.649067 | -16.649067 |
[
[
0,
0.14500812,
0
],
[
-0.04011125,
-0.01848225,
0
],
[
0.04011125,
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0
],
[
0.14595645,
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0
],
[
-0.14595645,
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0
],
[
0,
0.1234326,
0
],
[
0,
-0.18518157,
0
],
[
0,
-0.11657225,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-31
| 31 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.34354226,
-6.13271699,
0
],
[
3.34354226,
6.13271699,
0
],
[
0,
0,
5.22278256
]
] |
agm005266167
|
[
[
3.3435422599999995,
-2.3544801887155278,
2.61139128
],
[
1.812066263535868,
0.8779761386427631,
2.61139128
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[
4.8750182564641324,
0.8779761386427625,
2.61139128
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[
1.5130282360925402,
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0
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[
5.1740562839074595,
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0
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[
3.3435422600000004,
2.1926836600725133,
0
],
[
3.3435422599999995,
-4.4430683371431785,
0
],
[
3.3435422600000004,
4.791090949904533,
2.61139128
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.18836361,
0,
0
],
[
0,
3.84021917,
0
],
[
0,
0,
-0.95729853
]
] | -16.657204 | -16.657204 |
[
[
0,
0.11354387,
0
],
[
-0.05649371,
-0.02121036,
0
],
[
0.05649371,
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0
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[
0.11435044,
0.0459905,
0
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[
-0.11435044,
0.0459905,
0
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[
0,
0.12648539,
0
],
[
0,
-0.19054011,
0
],
[
0,
-0.09904944,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-32
| 32 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.347004,
-6.21082656,
0
],
[
3.347004,
6.21082656,
0
],
[
0,
0,
5.22382865
]
] |
agm005266167
|
[
[
3.347004,
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2.611914325
],
[
1.8241333794993602,
0.879614646603091,
2.611914325
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[
4.8698746205006405,
0.8796146466030912,
2.611914325
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[
1.5332292297102001,
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0
],
[
5.1607787702898005,
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0
],
[
3.347004,
2.2381600414992766,
0
],
[
3.347004,
-4.525753914837561,
0
],
[
3.347004,
4.875893733952685,
2.611914325
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-2.62986507,
0,
0
],
[
0,
0.33131586,
0
],
[
0,
0,
-2.93884467
]
] | -16.667584 | -16.667584 |
[
[
0,
0.05344318,
0
],
[
-0.08636135,
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0
],
[
0.08636135,
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0
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[
0.04018689,
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0
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[
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[
0,
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0
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[
0,
-0.19440173,
0
],
[
0,
-0.06022255,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-33
| 33 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.35392747,
-6.3670457,
0
],
[
3.35392747,
6.3670457,
0
],
[
0,
0,
5.22592083
]
] |
agm005266167
|
[
[
3.35392747,
-2.4719257776128356,
2.612960415
],
[
1.848309651137206,
0.8824176500860659,
2.612960415
],
[
4.859545288862794,
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2.612960415
],
[
1.5737082146412185,
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0
],
[
5.1341467253587805,
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0
],
[
3.3539274699999995,
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0
],
[
3.35392747,
-4.692421250123749,
0
],
[
3.35392747,
5.046680616689812,
2.612960415
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-8.05826535,
0,
0
],
[
0,
-6.85027878,
0
],
[
0,
0,
-7.44478363
]
] | -16.663553 | -16.663553 |
[
[
0,
-0.05611561,
0
],
[
-0.1463709,
-0.00848175,
0
],
[
0.1463709,
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0
],
[
-0.07236115,
0.07513106,
0
],
[
0.07236115,
0.07513106,
0
],
[
0,
0.11982261,
0
],
[
0,
-0.20102258,
0
],
[
0,
0.00401696,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-34
| 34 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.34961976,
-6.26984784,
0
],
[
3.34961976,
6.26984784,
0
],
[
0,
0,
5.2246191
]
] |
agm005266167
|
[
[
3.3496197599999995,
-2.4232864091973694,
2.61230955
],
[
1.8332837069691625,
0.8804946075888531,
2.61230955
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[
4.865955813030837,
0.8804946075888527,
2.61230955
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[
1.5485523609205414,
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0
],
[
5.1506871590794585,
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0
],
[
3.34961976,
2.2731813614264547,
0
],
[
3.3496197599999995,
-4.589212116961036,
0
],
[
3.34961976,
4.940864934663542,
2.61230955
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-4.82174684,
0,
0
],
[
0,
-2.42120105,
0
],
[
0,
0,
-4.65936435
]
] | -16.670036 | -16.670036 |
[
[
0,
0.00769486,
0
],
[
-0.10847988,
-0.01494198,
0
],
[
0.10847988,
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0
],
[
-0.01194447,
0.06341786,
0
],
[
0.01194447,
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0
],
[
0,
0.1171486,
0
],
[
0,
-0.19086232,
0
],
[
0,
-0.0309329,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-35
| 35 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.33789901,
-6.29752525,
0
],
[
3.33789901,
6.29752525,
0
],
[
0,
0,
5.20485811
]
] |
agm005266167
|
[
[
3.33789901,
-2.4380826182203297,
2.602429055
],
[
1.826687196597986,
0.8789115925061499,
2.602429055
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[
4.849110823402015,
0.8789115925061495,
2.602429055
],
[
1.5518426895121502,
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0
],
[
5.123955330487849,
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0
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[
3.33789901,
2.2976576292847204,
0
],
[
3.3378990100000006,
-4.6317600447952305,
0
],
[
3.33789901,
4.97297306169275,
2.602429055
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
-3.82882728,
0,
0
],
[
0,
-1.98985768,
0
],
[
0,
0,
-3.70885986
]
] | -16.679031 | -16.679031 |
[
[
0,
-0.03077165,
0
],
[
-0.10976986,
-0.00353975,
0
],
[
0.10976986,
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0
],
[
-0.01753148,
0.0540173,
0
],
[
0.01753148,
0.0540173,
0
],
[
0,
0.12400064,
0
],
[
0,
-0.16574031,
0
],
[
0,
-0.02844377,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-36
| 36 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.30273677,
-6.38055748,
0
],
[
3.30273677,
6.38055748,
0
],
[
0,
0,
5.14557517
]
] |
agm005266167
|
[
[
3.3027367700000005,
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2.572787585
],
[
1.8069034741348884,
0.8739470636195683,
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[
4.798570065865112,
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[
1.5614374388875807,
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0
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[
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0
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[
3.30273677,
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0
],
[
3.30273677,
-4.7602816485852415,
0
],
[
3.30273677,
5.069702955243353,
2.572787585
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.11862344,
0,
0
],
[
0,
-0.22594548,
0
],
[
0,
0,
-0.43187102
]
] | -16.697446 | -16.697446 |
[
[
0,
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0
],
[
-0.10614335,
0.02852749,
0
],
[
0.10614335,
0.02852749,
0
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[
-0.03188319,
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0
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[
0.03188319,
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0
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[
0,
0.13139145,
0
],
[
0,
-0.07157456,
0
],
[
0,
-0.04533626,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-37
| 37 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.23241229,
-6.54662194,
0
],
[
3.23241229,
6.54662194,
0
],
[
0,
0,
5.02700927
]
] |
agm005266167
|
[
[
3.23241229,
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2.513504635
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[
1.7673593357536617,
0.8631675856198615,
2.513504635
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4.697465244246338,
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[
1.5795104107466353,
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0
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[
4.885314169253364,
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0
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[
3.23241229,
2.521895071956791,
0
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[
3.23241229,
-5.0207901589166575,
0
],
[
3.23241229,
5.264763773416831,
2.513504635
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
11.0122573,
0,
0
],
[
0,
3.68790348,
0
],
[
0,
0,
7.56622396
]
] | -16.675436 | -16.675436 |
[
[
0,
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0
],
[
-0.06647138,
0.14405889,
0
],
[
0.06647138,
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0
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[
-0.07432243,
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0
],
[
0.07432243,
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0
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[
0,
0.10845803,
0
],
[
0,
0.15870306,
0
],
[
0,
-0.11042633,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-38
| 38 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.28735176,
-6.4168877,
0
],
[
3.28735176,
6.4168877,
0
],
[
0,
0,
5.1196363
]
] |
agm005266167
|
[
[
3.28735176,
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2.55981815
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[
1.7982668509922424,
0.8710829441123271,
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4.776436669007758,
0.8710829441123265,
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[
1.5646950514403208,
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0
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[
5.010008468559679,
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0
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[
3.28735176,
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0
],
[
3.28735176,
-4.81933484638661,
0
],
[
3.2873517600000004,
5.1133290481835,
2.55981815
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
2.464112,
0,
0
],
[
0,
1.03393758,
0
],
[
0,
0,
1.1047897
]
] | -16.700562 | -16.700562 |
[
[
0,
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0
],
[
-0.0999736,
0.04959051,
0
],
[
0.0999736,
0.04959051,
0
],
[
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0
],
[
0.03490544,
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0
],
[
0,
0.12636027,
0
],
[
0,
-0.0248345,
0
],
[
0,
-0.05394118,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-39
| 39 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.43522279,
-5.83400131,
0
],
[
3.43522279,
5.83400131,
0
],
[
0,
0,
5.24901806
]
] |
agm005266167
|
[
[
3.43522279,
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2.62450903
],
[
1.6821337194095403,
0.9533093012215194,
2.62450903
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5.18831186059046,
0.9533093012215188,
2.62450903
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[
1.4897959732719472,
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0
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[
5.380649606728053,
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0
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[
3.43522279,
1.9920584850681986,
0
],
[
3.43522279,
-4.085893806629949,
0
],
[
3.43522279,
4.015439139769656,
2.62450903
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
0.22133649,
0,
0
],
[
0,
-0.31892645,
0
],
[
0,
0,
0.08120529
]
] | -16.624827 | -16.624827 |
[
[
0,
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0
],
[
-0.00681049,
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0
],
[
0.00681049,
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0
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[
0.01141155,
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0
],
[
-0.01141155,
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0
],
[
0,
0.00527957,
0
],
[
0,
-0.01663663,
0
],
[
0,
0.03470659,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-4
| 4 | 0 |
[
"Mg",
"Mn",
"Rb"
] | 8 |
A6BC
|
Mg6MnRb
|
Rb Mg6 Mn
| 3 |
[
1,
1,
1
] | 3 |
[
[
3.28847222,
-6.45473479,
0
],
[
3.28847222,
6.45473479,
0
],
[
0,
0,
5.10933238
]
] |
agm005266167
|
[
[
3.2884722200000005,
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2.55466619
],
[
1.7896359092073002,
0.8753832574433562,
2.55466619
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[
4.7873085307927,
0.8753832574433567,
2.55466619
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[
1.5706160300997496,
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0
],
[
5.0063284099002505,
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0
],
[
3.28847222,
2.445719925271719,
0
],
[
3.28847222,
-4.871862381735977,
0
],
[
3.28847222,
5.148658062746936,
2.55466619
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
|
[
"Rb",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mg",
"Mn"
] |
2024-05-07 00:00:00
|
[
0.75,
0.125,
0.125
] |
[
[
1.14086154,
0,
0
],
[
0,
0.43054622,
0
],
[
0,
0,
0.39133213
]
] | -16.708878 | -16.708878 |
[
[
0,
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0
],
[
-0.04235758,
0.02934599,
0
],
[
0.04235758,
0.02934599,
0
],
[
-0.03024795,
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0
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[
0.03024795,
0.0067675,
0
],
[
0,
0.11107659,
0
],
[
0,
0.00699784,
0
],
[
0,
-0.0486798,
0
]
] |
pbe
| true | 38 |
agm005266167-pbe-40
| 40 | 0 |