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{
"id": "jvasp-10874",
"created_at": "2022-09-04T14:37:07.683224Z",
"updated_at": "2022-09-04T14:37:07.683249Z",
"structure_string": "Sm4 Cu4 Se8\n1.0\n0.000000 6.665754 0.009281\n7.427695 0.000000 0.000000\n0.000000 -0.795561 -7.120023\nSm Cu Se\n4 4 8\ndirect\n0.306029 0.544033 0.700630 Sm\n0.693971 0.044033 0.799369 Sm\n0.693971 0.455967 0.299369 Sm\n0.306029 0.955968 0.200631 Sm\n0.930182 0.839781 0.455279 Cu\n0.069817 0.160220 0.544721 Cu\n0.930182 0.660220 0.955279 Cu\n0.069817 0.339780 0.044721 Cu\n0.576608 0.724192 0.998700 Se\n0.576607 0.775809 0.498700 Se\n0.423392 0.224191 0.501300 Se\n0.423392 0.275809 0.001300 Se\n0.100987 0.610585 0.282522 Se\n0.899012 0.110584 0.217478 Se\n0.899012 0.389416 0.717478 Se\n0.100987 0.889416 0.782522 Se\n",
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{
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"structure_string": "Sm4 Cu4 S8\n1.0\n0.000000 6.440344 0.007069\n7.131200 0.000000 0.000000\n0.000000 -0.891927 -6.778079\nSm Cu S\n4 4 8\ndirect\n0.808178 0.951038 0.199117 Sm\n0.191821 0.451038 0.300883 Sm\n0.191821 0.048962 0.800883 Sm\n0.808178 0.548962 0.699117 Sm\n0.422864 0.661757 0.949755 Cu\n0.577135 0.338243 0.050245 Cu\n0.577134 0.161757 0.550245 Cu\n0.422865 0.838243 0.449755 Cu\n0.079521 0.726042 0.999393 S\n0.920478 0.226042 0.500607 S\n0.920478 0.273958 0.000607 S\n0.079521 0.773958 0.499393 S\n0.406800 0.113151 0.218815 S\n0.406799 0.386849 0.718815 S\n0.593199 0.886849 0.781185 S\n0.593200 0.613151 0.281185 S\n",
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"formula_full": "Sm4 Cu4 S8",
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{
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"created_at": "2022-09-04T14:38:05.006258Z",
"updated_at": "2022-09-04T14:38:05.006275Z",
"structure_string": "Sm4 Cu4\n1.0\n4.514614 0.000000 0.000000\n-0.000000 5.508001 0.000000\n0.000000 0.000000 7.230388\nSm Cu\n4 4\ndirect\n0.250000 0.129608 0.180219 Sm\n0.749999 0.629608 0.319781 Sm\n0.250000 0.370392 0.680219 Sm\n0.749999 0.870392 0.819781 Sm\n0.250000 0.624883 0.035282 Cu\n0.749999 0.124883 0.464718 Cu\n0.250000 0.875117 0.535282 Cu\n0.749999 0.375117 0.964718 Cu\n",
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"density_atomic": 0.04449526005205036,
"volume": 179.79443182580874,
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"formula_full": "Sm4 Cu4",
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"spacegroup": 62
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{
"id": "jvasp-113004",
"created_at": "2022-09-04T14:38:46.412130Z",
"updated_at": "2022-09-04T14:38:46.412164Z",
"structure_string": "Sm4 Cr4 Sb12\n1.0\n6.090274 -0.000000 0.000000\n0.000000 6.249907 0.000000\n0.000000 0.000000 12.948289\nSm Cr Sb\n4 4 12\ndirect\n0.250000 0.506165 0.309162 Sm\n0.749999 0.493835 0.690838 Sm\n0.250000 0.006165 0.690838 Sm\n0.749999 0.993835 0.309162 Sm\n-0.000000 0.750000 0.906029 Cr\n-0.000000 0.250000 0.093971 Cr\n0.500000 0.250000 0.093971 Cr\n0.500000 0.750000 0.906029 Cr\n0.749999 -0.004323 0.775562 Sb\n0.250000 0.004323 0.224438 Sb\n0.749999 0.899866 0.063516 Sb\n0.250000 0.100135 0.936484 Sb\n0.749999 0.399866 0.936484 Sb\n-0.000000 0.250000 0.497894 Sb\n0.500000 0.750000 0.502106 Sb\n0.500000 0.250000 0.497894 Sb\n0.250000 0.504323 0.775562 Sb\n-0.000000 0.750000 0.502106 Sb\n0.250000 0.600135 0.063516 Sb\n0.749999 0.495677 0.224438 Sb\n",
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"formula_full": "Sm4 Cr4 Sb12",
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{
"id": "jvasp-14118",
"created_at": "2022-09-04T14:37:01.300839Z",
"updated_at": "2022-09-04T14:37:01.300856Z",
"structure_string": "Sm4 Co4 O12\n1.0\n5.271143 0.000000 0.000000\n0.000000 5.463585 0.000000\n0.000000 0.000000 7.515500\nSm Co O\n4 4 12\ndirect\n0.014367 0.939375 0.750000 Sm\n0.514366 0.560624 0.250000 Sm\n0.485633 0.439375 0.750000 Sm\n0.985633 0.060625 0.250000 Sm\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.585230 0.017297 0.750000 O\n0.085230 0.482703 0.250000 O\n0.701346 0.295291 0.043973 O\n0.201346 0.204709 0.956027 O\n0.798654 0.795290 0.456027 O\n0.201346 0.204709 0.543973 O\n0.298654 0.704709 0.956027 O\n0.798654 0.795290 0.043973 O\n0.914769 0.517296 0.750000 O\n0.701346 0.295291 0.456027 O\n0.298654 0.704709 0.543973 O\n0.414769 0.982702 0.250000 O\n",
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"formula_full": "Sm4 Co4 O12",
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{
"id": "jvasp-23477",
"created_at": "2022-09-04T14:37:33.731881Z",
"updated_at": "2022-09-04T14:37:33.731889Z",
"structure_string": "Sm4 Co4 Ge4\n1.0\n4.352691 0.000000 0.000000\n0.000000 6.946258 0.000000\n0.000000 0.000000 7.164598\nSm Co Ge\n4 4 4\ndirect\n0.250000 0.686731 0.976811 Sm\n0.750000 0.313270 0.023190 Sm\n0.750000 0.186730 0.523190 Sm\n0.250000 0.813270 0.476810 Sm\n0.750000 0.569194 0.355204 Co\n0.750000 0.930807 0.855204 Co\n0.250000 0.069193 0.144796 Co\n0.250000 0.430807 0.644796 Co\n0.750000 0.606915 0.694529 Ge\n0.750000 0.893085 0.194528 Ge\n0.250000 0.106915 0.805472 Ge\n0.250000 0.393085 0.305472 Ge\n",
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"density": 8.644795555020584,
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"formula_full": "Sm4 Co4 Ge4",
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"spacegroup": 62
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{
"id": "jvasp-98505",
"created_at": "2022-09-04T14:35:57.723318Z",
"updated_at": "2022-09-04T14:35:57.723342Z",
"structure_string": "Sm4 Co14 B6\n1.0\n5.061380 -0.000000 0.000000\n-2.530690 4.383284 0.000000\n-0.000000 -0.000000 12.778825\nSm Co B\n4 14 6\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.000000 0.500000 Sm\n0.000000 0.000000 0.260108 Sm\n0.000000 0.000000 0.739892 Sm\n-0.000000 0.500000 0.615873 Co\n0.500000 0.500000 0.615873 Co\n0.500000 0.000000 0.615873 Co\n-0.000000 0.500000 0.384127 Co\n0.500000 0.500000 0.384127 Co\n0.500000 0.000000 0.384127 Co\n-0.000000 0.500000 0.845534 Co\n0.500000 0.000000 0.845534 Co\n-0.000000 0.500000 0.154466 Co\n0.500000 0.500000 0.154466 Co\n0.500000 0.000000 0.154466 Co\n0.666667 0.333333 0.000000 Co\n0.333333 0.666666 0.000000 Co\n0.500000 0.500000 0.845534 Co\n0.666667 0.333333 0.732354 B\n0.333333 0.666666 0.500000 B\n0.666667 0.333333 0.500000 B\n0.333333 0.666666 0.267646 B\n0.666667 0.333333 0.267646 B\n0.333333 0.666666 0.732354 B\n",
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{
"id": "jvasp-97825",
"created_at": "2022-09-04T14:36:17.503829Z",
"updated_at": "2022-09-04T14:36:17.503853Z",
"structure_string": "Sm4 Cl8\n1.0\n3.492252 0.000000 0.000000\n0.000000 9.606944 0.000000\n0.000000 0.000000 8.622579\nSm Cl\n4 8\ndirect\n0.250000 0.684043 0.365214 Sm\n0.750000 0.315957 0.634786 Sm\n0.250000 0.184043 0.134786 Sm\n0.750000 0.815956 0.865214 Sm\n0.250000 0.555828 0.667645 Cl\n0.750000 0.444171 0.332356 Cl\n0.250000 0.055828 0.832356 Cl\n0.750000 0.944171 0.167644 Cl\n0.750000 0.849997 0.546193 Cl\n0.250000 0.150002 0.453807 Cl\n0.750000 0.349998 0.953807 Cl\n0.250000 0.650002 0.046193 Cl\n",
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{
"id": "jvasp-13292",
"created_at": "2022-09-04T14:36:37.247685Z",
"updated_at": "2022-09-04T14:36:37.247695Z",
"structure_string": "Sm4 Cd2 S8\n1.0\n7.360284 0.142972 0.000000\n-2.318633 6.987000 -0.000000\n-2.520826 -3.564986 5.927102\nSm Cd S\n4 2 8\ndirect\n0.111766 0.749999 0.861766 Sm\n0.250000 0.611766 0.361766 Sm\n0.388233 0.249999 0.638233 Sm\n0.750000 0.888233 0.138234 Sm\n0.625000 0.375000 0.250000 Cd\n0.874999 0.124999 0.750000 Cd\n0.007947 0.881280 0.511908 S\n0.492052 0.003960 0.873333 S\n0.118720 0.130628 0.126667 S\n0.381280 0.507947 0.011908 S\n0.630627 0.618719 0.626667 S\n0.503961 0.992052 0.373333 S\n0.869371 0.496038 0.988091 S\n0.996038 0.369371 0.488092 S\n",
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{
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"structure_string": "Sm4 Cd2 Rh4\n1.0\n7.592896 0.000000 0.000000\n0.000000 7.592896 0.000000\n-0.000000 -0.000000 3.819017\nSm Cd Rh\n4 2 4\ndirect\n0.666229 0.166229 0.500000 Sm\n0.333772 0.833772 0.500000 Sm\n0.166229 0.333772 0.500000 Sm\n0.833772 0.666229 0.500000 Sm\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 -0.000000 Cd\n0.135216 0.635217 -0.000000 Rh\n0.864784 0.364784 -0.000000 Rh\n0.635217 0.864784 -0.000000 Rh\n0.364784 0.135216 -0.000000 Rh\n",
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{
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"created_at": "2022-09-04T14:37:37.228260Z",
"updated_at": "2022-09-04T14:37:37.228280Z",
"structure_string": "Sm4 Cd2 Pd4\n1.0\n7.763739 0.000000 0.000000\n-0.000000 7.763739 0.000000\n0.000000 -0.000000 3.818958\nSm Cd Pd\n4 2 4\ndirect\n0.326974 0.826974 0.500000 Sm\n0.826974 0.673026 0.500000 Sm\n0.173026 0.326974 0.500000 Sm\n0.673026 0.173026 0.500000 Sm\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Cd\n0.371977 0.128023 0.000000 Pd\n0.871977 0.371977 0.000000 Pd\n0.128023 0.628023 0.000000 Pd\n0.628023 0.871977 0.000000 Pd\n",
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{
"id": "jvasp-54806",
"created_at": "2022-09-04T14:37:44.885166Z",
"updated_at": "2022-09-04T14:37:44.885185Z",
"structure_string": "Sm4 Bi4 Rh4\n1.0\n4.753384 0.000000 0.000000\n0.000000 7.359846 0.000000\n0.000000 0.000000 8.063762\nSm Bi Rh\n4 4 4\ndirect\n0.250000 0.012128 0.305474 Sm\n0.749999 0.987872 0.694526 Sm\n0.749999 0.487872 0.805474 Sm\n0.250000 0.512128 0.194526 Sm\n0.749999 0.817967 0.090607 Bi\n0.250000 0.682034 0.590607 Bi\n0.250000 0.182034 0.909393 Bi\n0.749999 0.317967 0.409393 Bi\n0.749999 0.214609 0.079119 Rh\n0.749999 0.714609 0.420881 Rh\n0.250000 0.285392 0.579119 Rh\n0.250000 0.785392 0.920881 Rh\n",
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]
}