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"id": "jvasp-15383",
"created_at": "2022-09-04T14:37:02.601726Z",
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{
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{
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"structure_string": "Sb8 S8 O4\n1.0\n5.880775 -0.056147 0.051646\n-2.787334 7.707246 0.003921\n-2.522330 -3.091309 10.002770\nSb S O\n8 8 4\ndirect\n0.336161 0.355844 0.100574 Sb\n0.663840 0.644157 0.899427 Sb\n0.360874 0.870282 0.134372 Sb\n0.639128 0.129718 0.865628 Sb\n0.982553 0.338440 0.367791 Sb\n0.017449 0.661560 0.632209 Sb\n0.963853 0.832028 0.366446 Sb\n0.036149 0.167972 0.633554 Sb\n0.482625 0.705307 0.304913 S\n0.517377 0.294694 0.695087 S\n0.497977 0.191291 0.298284 S\n0.502025 0.808709 0.701716 S\n0.225168 0.524292 0.912866 S\n0.774685 0.954688 0.087492 S\n0.774833 0.475708 0.087134 S\n0.225317 0.045313 0.912508 S\n0.961152 0.099584 0.430795 O\n0.926456 0.586788 0.428710 O\n0.073546 0.413212 0.571291 O\n0.038849 0.900416 0.569205 O\n",
"nsites": 20,
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],
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"formula_full": "Sb8 S8 O4",
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{
"id": "jvasp-15976",
"created_at": "2022-09-04T14:36:56.785014Z",
"updated_at": "2022-09-04T14:36:56.785042Z",
"structure_string": "Ba1 Mg2 Ge2\n1.0\n4.354034 -0.000000 -1.659227\n-0.632295 4.307878 -1.659227\n0.033971 0.039322 6.631542\nBa Mg Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.749999 0.250000 0.499999 Mg\n0.249999 0.750000 0.499999 Mg\n0.616636 0.616637 0.233273 Ge\n0.383362 0.383363 0.766725 Ge\n",
"nsites": 5,
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"density_atomic": 0.04001484102001319,
"volume": 124.95363901356698,
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{
"id": "jvasp-104642",
"created_at": "2022-09-04T14:36:49.063261Z",
"updated_at": "2022-09-04T14:36:49.063293Z",
"structure_string": "Ho4 Co2 Si4\n1.0\n4.963939 -0.009091 2.513990\n3.259701 3.743677 2.513990\n-0.001506 -0.000684 9.937293\nHo Co Si\n4 2 4\ndirect\n0.000417 0.000418 0.328476 Ho\n-0.000418 -0.000417 0.671523 Ho\n0.813670 0.813672 0.106288 Ho\n0.186328 0.186331 0.893711 Ho\n0.726844 0.726847 0.623921 Co\n0.273154 0.273155 0.376079 Co\n0.651805 0.651808 0.433309 Si\n0.348193 0.348195 0.566691 Si\n0.507495 0.507496 0.125735 Si\n0.492503 0.492506 0.874265 Si\n",
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{
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"created_at": "2022-09-04T14:36:47.628636Z",
"updated_at": "2022-09-04T14:36:47.628666Z",
"structure_string": "Ba1 Cu2 As2\n1.0\n3.971506 -0.000000 -1.604073\n-0.647877 3.918306 -1.604073\n0.305957 0.360701 6.476061\nBa Cu As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750001 0.250000 0.500001 Cu\n0.250000 0.750001 0.500001 Cu\n0.638205 0.638206 0.276411 As\n0.361796 0.361795 0.723590 As\n",
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{
"id": "jvasp-15808",
"created_at": "2022-09-04T14:36:57.140921Z",
"updated_at": "2022-09-04T14:36:57.140940Z",
"structure_string": "Sr1 Cd2 Sb2\n1.0\n2.388294 -4.136647 0.000000\n2.388294 4.136647 -0.000000\n-0.000000 -0.000000 7.830924\nSr Cd Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.333332 0.666666 0.366781 Cd\n0.666666 0.333332 0.633219 Cd\n0.333332 0.666666 0.752158 Sb\n0.666666 0.333332 0.247842 Sb\n",
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"spacegroup": 164
},
{
"id": "jvasp-105305",
"created_at": "2022-09-04T14:36:57.484786Z",
"updated_at": "2022-09-04T14:36:57.484824Z",
"structure_string": "Sm2 Cd1 Ni2\n1.0\n7.439722 0.014425 0.000000\n-6.407666 3.780408 0.000000\n0.000000 0.000000 3.745849\nSm Cd Ni\n2 1 2\ndirect\n0.636847 0.363152 0.500000 Sm\n0.363152 0.636848 0.500000 Sm\n0.000000 0.000000 0.000000 Cd\n0.799510 0.200488 -0.000000 Ni\n0.200489 0.799511 -0.000000 Ni\n",
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{
"id": "jvasp-29339",
"created_at": "2022-09-04T14:37:05.740678Z",
"updated_at": "2022-09-04T14:37:05.740699Z",
"structure_string": "Nb2 Se4 Br4\n1.0\n6.233294 0.000503 2.500822\n2.587680 5.731136 2.561664\n0.033479 0.011220 7.430995\nNb Se Br\n2 4 4\ndirect\n0.875270 0.251966 0.999500 Nb\n0.124730 0.748034 0.000498 Nb\n0.741148 0.039071 0.863814 Se\n0.258852 0.960929 0.136184 Se\n0.081364 0.092074 0.669820 Se\n0.918636 0.907926 0.330179 Se\n0.582707 0.649534 0.769239 Br\n0.417293 0.350466 0.230760 Br\n0.828399 0.521721 0.229963 Br\n0.171600 0.478279 0.770036 Br\n",
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"formula_full": "Nb2 Se4 Br4",
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{
"id": "jvasp-102633",
"created_at": "2022-09-04T14:36:55.405172Z",
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"structure_string": "Cr2 B4 Mo4\n1.0\n5.830128 0.000000 0.000000\n0.000000 5.830128 0.000000\n0.000000 -0.000000 3.126428\nCr B Mo\n2 4 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 -0.000000 Cr\n0.113740 0.613740 -0.000000 B\n0.886261 0.386260 -0.000000 B\n0.613740 0.886261 -0.000000 B\n0.386260 0.113740 -0.000000 B\n0.677702 0.177702 0.500000 Mo\n0.322298 0.822298 0.500000 Mo\n0.177702 0.322298 0.500000 Mo\n0.822298 0.677702 0.500000 Mo\n",
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{
"id": "jvasp-107098",
"created_at": "2022-09-04T14:37:02.470457Z",
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"structure_string": "Tm4 Te2 O4\n1.0\n3.844215 -0.000000 0.000000\n-1.922107 3.329189 0.000000\n-0.000000 -0.000000 14.227734\nTm Te O\n4 2 4\ndirect\n0.333333 0.666667 0.902887 Tm\n0.333333 0.666667 0.597112 Tm\n0.666667 0.333333 0.402888 Tm\n0.666667 0.333333 0.097112 Tm\n0.000000 0.000000 0.250000 Te\n0.000000 0.000000 0.750000 Te\n0.333333 0.666667 0.060053 O\n0.333333 0.666667 0.439947 O\n0.666667 0.333333 0.939947 O\n0.666667 0.333333 0.560052 O\n",
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{
"id": "jvasp-8274",
"created_at": "2022-09-04T14:37:04.478251Z",
"updated_at": "2022-09-04T14:37:04.478281Z",
"structure_string": "Mg1 Cr2 N2\n1.0\n3.694593 0.000000 0.000000\n0.000000 3.694531 0.000000\n0.000000 0.000000 5.403786\nMg Cr N\n1 2 2\ndirect\n0.000000 0.000000 0.249998 Mg\n0.500000 0.500000 0.998088 Cr\n0.500000 0.500000 0.501915 Cr\n0.500000 0.000000 0.474465 N\n0.000000 0.500000 0.025536 N\n",
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