ids stringlengths 5 10 | cell listlengths 3 3 | pos listlengths 1 20 | atomic_numbers listlengths 1 20 | new_split stringclasses 1
value | new_index int64 0 27.1k | mpid stringlengths 5 10 | source_global_index int64 0 45.2k | source_split stringclasses 3
values | source_lmdb_key int64 0 27.1k |
|---|---|---|---|---|---|---|---|---|---|
mp-1018096 | [
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mp-1215216 | [
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mp-23719 | [
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mp-1222331 | [
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mp-11194 | [
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mp-1095657 | [
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mp-23105 | [
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mp-1539667 | [
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mp-1217590 | [
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mp-975288 | [
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mp-752829 | [
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mp-998620 | [
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mp-1213895 | [
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mp-1079976 | [
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mp-22497 | [
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mp-561182 | [
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mp-972209 | [
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mp-2142 | [
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mp-580215 | [
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mp-1186630 | [
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mp-1079182 | [
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mp-1114645 | [
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mp-31361 | [
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mp-1491 | [
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1.4776930640923018,
4.179547144527977,
2.5594394650000005
],
[
0,
0,
5.118878929999999
]
] | [
[
4.43307919,
3.13466036,
7.67831839
],
[
1.47769306,
1.04488679,
2.55943947
],
[
0,
0,
0
],
[
2.95538613,
2.08977357,
5.11887893
]
] | [
64,
64,
30,
31
] | train | 3,599 | mp-1184388 | 5,931 | train | 15,335 |
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