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{
"id": "mp-1022052",
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"structure_string": "Hf2 Mg12 Co2\n1.0\n4.796372 0.000000 0.000000\n0.000000 6.097363 0.000000\n0.000000 0.000000 11.135462\nHf Mg Co\n2 12 2\ndirect\n0.500000 0.500000 0.193415 Hf\n0.500000 0.000000 0.693415 Hf\n0.000000 0.743332 0.080247 Mg\n0.000000 0.256668 0.080247 Mg\n0.000000 0.000000 0.327157 Mg\n0.500000 0.257264 0.425788 Mg\n0.500000 0.742736 0.425788 Mg\n0.500000 0.000000 0.166602 Mg\n0.000000 0.243332 0.580247 Mg\n0.000000 0.756668 0.580247 Mg\n0.000000 0.500000 0.827157 Mg\n0.500000 0.757264 0.925788 Mg\n0.500000 0.242736 0.925788 Mg\n0.500000 0.500000 0.666602 Mg\n0.000000 0.500000 0.300755 Co\n0.000000 0.000000 0.800755 Co\n",
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{
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{
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"structure_string": "Tm1 Ni2 P2\n1.0\n-1.922036 1.922036 4.659406\n1.922036 -1.922036 4.659406\n1.922036 1.922036 -4.659406\nTm Ni P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.250000 0.750000 0.500000 Ni\n0.750000 0.250000 0.500000 Ni\n0.378259 0.378259 0.000000 P\n0.621741 0.621741 0.000000 P\n",
"nsites": 5,
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{
"id": "mp-12385",
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"structure_string": "Ba2 Y1 Ta1 O6\n1.0\n-3.012732 3.012732 4.283243\n3.012732 -3.012732 4.283243\n3.012732 3.012732 -4.283243\nBa Y Ta O\n2 1 1 6\ndirect\n0.750000 0.250000 0.500000 Ba\n0.250000 0.750000 0.500000 Ba\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.000000 Ta\n0.708989 0.761405 0.470394 O\n0.761405 0.291011 0.052416 O\n0.238595 0.708989 0.947584 O\n0.291011 0.238595 0.529606 O\n0.264498 0.264498 0.000000 O\n0.735502 0.735502 0.000000 O\n",
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{
"id": "mp-1215110",
"created_at": "2022-09-04T14:45:02.794674Z",
"structure_string": "Co4 Mo12 O72\n1.0\n19.964813 0.000000 0.000000\n0.000000 7.773302 0.000000\n0.000000 3.288803 10.691938\nCo Mo O\n4 12 72\ndirect\n0.510308 0.740364 0.779162 Co\n0.489692 0.259636 0.220838 Co\n0.010308 0.759636 0.220838 Co\n0.989692 0.240364 0.779162 Co\n0.231206 0.136027 0.783461 Mo\n0.768794 0.863973 0.216539 Mo\n0.731206 0.363973 0.216539 Mo\n0.268794 0.636027 0.783461 Mo\n0.141703 0.913948 0.624192 Mo\n0.858297 0.086052 0.375808 Mo\n0.641703 0.586052 0.375808 Mo\n0.358297 0.413948 0.624192 Mo\n0.263817 0.227336 0.464987 Mo\n0.736183 0.772664 0.535013 Mo\n0.763817 0.272664 0.535013 Mo\n0.236183 0.727336 0.464987 Mo\n0.264582 0.471961 0.494595 O\n0.735418 0.528039 0.505405 O\n0.764582 0.028039 0.505405 O\n0.235418 0.971961 0.494595 O\n0.049200 0.336283 0.661293 O\n0.950800 0.663717 0.338707 O\n0.549200 0.163717 0.338707 O\n0.450800 0.836283 0.661293 O\n0.334377 0.739513 0.249650 O\n0.665623 0.260487 0.750350 O\n0.834377 0.760487 0.750350 O\n0.165623 0.239513 0.249650 O\n0.052112 0.558923 0.309302 O\n0.947888 0.441077 0.690698 O\n0.552112 0.941077 0.690698 O\n0.447888 0.058923 0.309302 O\n0.414555 0.474181 0.503483 O\n0.585445 0.525819 0.496517 O\n0.914555 0.025819 0.496517 O\n0.085445 0.974181 0.503483 O\n0.239816 0.867510 0.768645 O\n0.760184 0.132490 0.231355 O\n0.739816 0.632490 0.231355 O\n0.260184 0.367510 0.768645 O\n0.572080 0.640436 0.893748 O\n0.427920 0.359564 0.106252 O\n0.072080 0.859564 0.106252 O\n0.927920 0.140436 0.893748 O\n0.031598 0.050435 0.876900 O\n0.968402 0.949565 0.123100 O\n0.531598 0.449565 0.123100 O\n0.468402 0.550435 0.876900 O\n0.786938 0.550023 0.966636 O\n0.213062 0.449977 0.033364 O\n0.286938 0.949977 0.033364 O\n0.713062 0.050023 0.966636 O\n0.179587 0.154479 0.633872 O\n0.820413 0.845521 0.366128 O\n0.679587 0.345521 0.366128 O\n0.320413 0.654479 0.633872 O\n0.318970 0.255549 0.345429 O\n0.681030 0.744451 0.654571 O\n0.818970 0.244451 0.654571 O\n0.181030 0.755549 0.345429 O\n0.318276 0.179833 0.622983 O\n0.681724 0.820167 0.377017 O\n0.818276 0.320167 0.377017 O\n0.181724 0.679833 0.622983 O\n0.172463 0.305587 0.338697 O\n0.827537 0.694413 0.661303 O\n0.672463 0.194413 0.661303 O\n0.327537 0.805587 0.338697 O\n0.094569 0.846341 0.758471 O\n0.905431 0.153659 0.241529 O\n0.594569 0.653659 0.241529 O\n0.405431 0.346341 0.758471 O\n0.476382 0.918318 0.831371 O\n0.523618 0.081682 0.168629 O\n0.976382 0.581682 0.168629 O\n0.023618 0.418318 0.831371 O\n0.452636 0.428918 0.275772 O\n0.547364 0.571082 0.724228 O\n0.952636 0.071082 0.724228 O\n0.047364 0.928918 0.275772 O\n0.169710 0.102682 0.891992 O\n0.830290 0.897318 0.108008 O\n0.669710 0.397318 0.108008 O\n0.330290 0.602682 0.891992 O\n0.305215 0.013499 0.918642 O\n0.694785 0.986501 0.081358 O\n0.805215 0.486501 0.081358 O\n0.194785 0.513499 0.918642 O\n",
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"elements": [
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"chemical_system": "Co-Mo-O",
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"volume": 1659.3088106981572,
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"spacegroup": 14
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{
"id": "mp-19394",
"created_at": "2022-09-04T14:45:02.840296Z",
"structure_string": "Li2 V4 O8\n1.0\n0.000000 4.189796 4.189796\n4.189796 0.000000 4.189796\n4.189796 4.189796 0.000000\nLi V O\n2 4 8\ndirect\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Li\n0.625000 0.625000 0.625000 V\n0.125000 0.625000 0.625000 V\n0.625000 0.625000 0.125000 V\n0.625000 0.125000 0.625000 V\n0.864023 0.407931 0.864023 O\n0.864023 0.864023 0.407931 O\n0.385977 0.842069 0.385977 O\n0.385977 0.385977 0.842069 O\n0.842069 0.385977 0.385977 O\n0.864023 0.864023 0.864023 O\n0.407931 0.864023 0.864023 O\n0.385977 0.385977 0.385977 O\n",
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{
"id": "mp-1378965",
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"structure_string": "Ca4 Bi4 O12\n1.0\n5.832270 0.000000 0.000000\n0.000000 6.081048 0.000000\n0.000000 0.000000 8.413914\nCa Bi O\n4 4 12\ndirect\n0.989283 0.056585 0.750000 Ca\n0.489283 0.443415 0.250000 Ca\n0.510717 0.556585 0.750000 Ca\n0.010717 0.943415 0.250000 Ca\n0.500000 0.000000 0.500000 Bi\n0.000000 0.500000 0.500000 Bi\n0.000000 0.500000 0.000000 Bi\n0.500000 0.000000 0.000000 Bi\n0.871404 0.564870 0.250000 O\n0.371404 0.935130 0.750000 O\n0.628596 0.064870 0.250000 O\n0.128596 0.435130 0.750000 O\n0.684717 0.310922 0.933661 O\n0.184717 0.189078 0.066339 O\n0.815283 0.810922 0.566339 O\n0.315283 0.689078 0.433661 O\n0.684717 0.310922 0.566339 O\n0.184717 0.189078 0.433661 O\n0.315283 0.689078 0.066339 O\n0.815283 0.810922 0.933661 O\n",
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{
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{
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