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{
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{
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"formula_full": "Eu2 Al2 Ge2",
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},
{
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"created_at": "2022-09-04T14:39:10.019563Z",
"structure_string": "Li2 Pr2 Sn4\n1.0\n2.246813 -9.673015 0.000000\n2.246813 9.673015 0.000000\n0.000000 0.000000 4.575159\nLi Pr Sn\n2 2 4\ndirect\n0.674118 0.325882 0.750000 Li\n0.325882 0.674118 0.250000 Li\n0.894359 0.105641 0.750000 Pr\n0.105641 0.894359 0.250000 Pr\n0.543317 0.456683 0.750000 Sn\n0.456683 0.543317 0.250000 Sn\n0.250642 0.749358 0.750000 Sn\n0.749358 0.250642 0.250000 Sn\n",
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"volume": 198.86803227739495,
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"formula_full": "Li2 Pr2 Sn4",
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"energy": -34.03561429,
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{
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"structure_string": "Ba1 Y1 V1 Cu1 O5\n1.0\n3.918869 0.000000 0.000000\n0.000000 3.918869 0.000000\n0.000000 0.000000 8.008632\nBa Y V Cu O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.008658 Ba\n0.000000 0.000000 0.459745 Y\n0.500000 0.500000 0.701364 V\n0.500000 0.500000 0.268570 Cu\n0.000000 0.500000 0.631976 O\n0.500000 0.000000 0.631976 O\n0.000000 0.500000 0.275469 O\n0.500000 0.000000 0.275469 O\n0.500000 0.500000 0.929611 O\n",
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"formula_full": "Ba1 Y1 V1 Cu1 O5",
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{
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"created_at": "2022-09-04T14:39:10.028087Z",
"structure_string": "Mg8 Si14\n1.0\n4.020225 0.000000 0.000000\n-0.015067 7.128301 0.000000\n-1.896302 -1.243906 14.271761\nMg Si\n8 14\ndirect\n0.013305 0.068712 0.919109 Mg\n0.817957 0.313471 0.511213 Mg\n0.236261 0.124356 0.360635 Mg\n0.393359 0.515182 0.654773 Mg\n0.970610 0.562314 0.831281 Mg\n0.160020 0.590676 0.214787 Mg\n0.287756 0.613642 0.425620 Mg\n0.348536 0.016030 0.580834 Mg\n0.526398 0.415411 0.955433 Si\n0.530431 0.759407 0.960994 Si\n0.077772 0.801319 0.055430 Si\n0.069505 0.391528 0.045634 Si\n0.855045 0.699093 0.561371 Si\n0.779611 0.929611 0.449552 Si\n0.654950 0.136403 0.219747 Si\n0.457883 0.857458 0.802296 Si\n0.909597 0.235727 0.701926 Si\n0.106352 0.115969 0.125911 Si\n0.743659 0.411642 0.326456 Si\n0.458098 0.230106 0.806620 Si\n0.915499 0.887290 0.706539 Si\n0.683648 0.828351 0.287427 Si\n",
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{
"id": "mp-1394188",
"created_at": "2022-09-04T14:39:10.031430Z",
"structure_string": "Ca2 Ti4 S8\n1.0\n0.000000 5.369059 5.369059\n5.369059 0.000000 5.369059\n5.369059 5.369059 0.000000\nCa Ti S\n2 4 8\ndirect\n0.500000 0.500000 0.500000 Ca\n0.750000 0.750000 0.750000 Ca\n0.125000 0.125000 0.125000 Ti\n0.625000 0.125000 0.125000 Ti\n0.125000 0.625000 0.125000 Ti\n0.125000 0.125000 0.625000 Ti\n0.358877 0.358877 0.358877 S\n0.326630 0.891123 0.891123 S\n0.891123 0.891123 0.326630 S\n0.891123 0.326630 0.891123 S\n0.358877 0.358877 0.923370 S\n0.358877 0.923370 0.358877 S\n0.891123 0.891123 0.891123 S\n0.923370 0.358877 0.358877 S\n",
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{
"id": "mp-1044397",
"created_at": "2022-09-04T14:39:10.044608Z",
"structure_string": "Ti2 Zn2 P6 W2 O24\n1.0\n8.698914 -0.179602 -0.125250\n4.441199 7.481919 -0.125250\n4.441199 2.468095 7.064227\nTi Zn P W O\n2 2 6 2 24\ndirect\n0.146640 0.146640 0.146640 Ti\n0.646640 0.646640 0.646640 Ti\n0.001941 0.001941 0.001941 Zn\n0.501941 0.501941 0.501941 Zn\n0.041480 0.448471 0.759201 P\n0.448471 0.759201 0.041480 P\n0.759201 0.041480 0.448471 P\n0.259201 0.948471 0.541480 P\n0.541480 0.259201 0.948471 P\n0.948471 0.541480 0.259201 P\n0.357894 0.357894 0.357894 W\n0.857894 0.857894 0.857894 W\n0.093991 0.502356 0.330944 O\n0.330944 0.093991 0.502356 O\n0.051517 0.253972 0.918000 O\n0.502356 0.330944 0.093991 O\n0.002356 0.593991 0.830944 O\n0.235480 0.432980 0.602860 O\n0.253972 0.918000 0.051517 O\n0.432980 0.602860 0.235480 O\n0.193349 0.001578 0.377344 O\n0.602860 0.235480 0.432980 O\n0.102860 0.932980 0.735480 O\n0.377344 0.193349 0.001578 O\n0.593991 0.830944 0.002356 O\n0.918000 0.051517 0.253972 O\n0.418000 0.753972 0.551517 O\n0.830944 0.002356 0.593991 O\n0.551517 0.418000 0.753972 O\n0.735480 0.102860 0.932980 O\n0.753972 0.551517 0.418000 O\n0.001578 0.377344 0.193349 O\n0.501578 0.693349 0.877344 O\n0.932980 0.735480 0.102860 O\n0.693349 0.877344 0.501578 O\n0.877344 0.501578 0.693349 O\n",
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{
"id": "mp-1203980",
"created_at": "2022-09-04T14:39:10.062117Z",
"structure_string": "Lu11 Ni60 C6\n1.0\n-6.169280 6.169280 6.169280\n6.169280 -6.169280 6.169280\n6.169280 6.169280 -6.169280\nLu Ni C\n11 60 6\ndirect\n0.000000 0.000000 0.336862 Lu\n0.000000 0.336862 0.000000 Lu\n0.336862 0.000000 0.000000 Lu\n0.663138 0.663138 0.663138 Lu\n0.000000 0.000000 0.663138 Lu\n0.000000 0.663138 0.000000 Lu\n0.663138 0.000000 0.000000 Lu\n0.336862 0.336862 0.336862 Lu\n0.500000 0.500000 0.000000 Lu\n0.500000 0.000000 0.500000 Lu\n0.000000 0.500000 0.500000 Lu\n0.000000 0.767408 0.419376 Ni\n0.232592 0.232592 0.651968 Ni\n0.767408 0.000000 0.419376 Ni\n0.000000 0.419376 0.767408 Ni\n0.767408 0.419376 0.000000 Ni\n0.232592 0.651968 0.232592 Ni\n0.651968 0.232592 0.232592 Ni\n0.419376 0.767408 0.000000 Ni\n0.419376 0.000000 0.767408 Ni\n0.348032 0.580623 0.580623 Ni\n0.580623 0.580623 0.348032 Ni\n0.580623 0.348032 0.580623 Ni\n0.000000 0.232592 0.580623 Ni\n0.767408 0.767408 0.348032 Ni\n0.232592 0.000000 0.580623 Ni\n0.000000 0.580623 0.232592 Ni\n0.232592 0.580623 0.000000 Ni\n0.767408 0.348032 0.767408 Ni\n0.348032 0.767408 0.767408 Ni\n0.580623 0.232592 0.000000 Ni\n0.580623 0.000000 0.232592 Ni\n0.651968 0.419376 0.419376 Ni\n0.419376 0.419376 0.651968 Ni\n0.419376 0.651968 0.419376 Ni\n0.148602 0.317236 0.465837 Ni\n0.682764 0.831366 0.148602 Ni\n0.168634 0.851398 0.317236 Ni\n0.851398 0.168634 0.317236 Ni\n0.317236 0.148602 0.465837 Ni\n0.831366 0.682764 0.148602 Ni\n0.851398 0.317236 0.168634 Ni\n0.317236 0.465837 0.148602 Ni\n0.831366 0.148602 0.682764 Ni\n0.148602 0.465837 0.317236 Ni\n0.682764 0.148602 0.831366 Ni\n0.168634 0.317236 0.851398 Ni\n0.148602 0.682764 0.831366 Ni\n0.317236 0.168634 0.851398 Ni\n0.465837 0.148602 0.317236 Ni\n0.148602 0.831366 0.682764 Ni\n0.317236 0.851398 0.168634 Ni\n0.465837 0.317236 0.148602 Ni\n0.851398 0.682764 0.534163 Ni\n0.682764 0.534163 0.851398 Ni\n0.534163 0.851398 0.682764 Ni\n0.851398 0.534163 0.682764 Ni\n0.682764 0.851398 0.534163 Ni\n0.534163 0.682764 0.851398 Ni\n0.855399 0.855399 0.000000 Ni\n0.144601 0.000000 0.144601 Ni\n0.000000 0.144601 0.144601 Ni\n0.144601 0.144601 0.000000 Ni\n0.855399 0.000000 0.855399 Ni\n0.000000 0.855399 0.855399 Ni\n0.750000 0.250000 0.500000 Ni\n0.750000 0.500000 0.250000 Ni\n0.500000 0.250000 0.750000 Ni\n0.250000 0.500000 0.750000 Ni\n0.250000 0.750000 0.500000 Ni\n0.500000 0.750000 0.250000 Ni\n0.706247 0.706247 0.000000 C\n0.293753 0.000000 0.293753 C\n0.000000 0.293753 0.293753 C\n0.293753 0.293753 0.000000 C\n0.706247 0.000000 0.706247 C\n0.000000 0.706247 0.706247 C\n",
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{
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