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{
"id": "jvasp-107062",
"created_at": "2022-09-04T14:36:45.882336Z",
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{
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"structure_string": "Yb1 Zn2 Ga2\n1.0\n3.913587 -0.011427 -4.740653\n-0.514366 3.879654 -4.740653\n0.010042 0.011427 6.147345\nYb Zn Ga\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.750000 0.250000 0.500001 Zn\n0.249999 0.749999 0.500000 Zn\n0.386457 0.386457 -0.000000 Ga\n0.613542 0.613541 -0.000000 Ga\n",
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{
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"structure_string": "Th1 Ge2 Rh2\n1.0\n3.919188 -0.000000 -1.521415\n-0.590608 3.874432 -1.521415\n0.077081 0.089721 6.007213\nTh Ge Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.621972 0.621972 0.243944 Ge\n0.378027 0.378027 0.756054 Ge\n0.750000 0.250000 0.499999 Rh\n0.250000 0.750000 0.499999 Rh\n",
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"volume": 92.28725436952851,
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{
"id": "jvasp-11153",
"created_at": "2022-09-04T14:36:40.268557Z",
"updated_at": "2022-09-04T14:36:40.268582Z",
"structure_string": "Sr2 Cu4 O4\n1.0\n4.936308 0.000000 -2.404545\n-1.171287 4.795333 -2.404545\n0.009394 0.011965 6.288450\nSr Cu O\n2 4 4\ndirect\n0.625000 0.375000 0.250001 Sr\n0.374999 0.625000 0.750001 Sr\n0.500000 0.000000 0.500001 Cu\n0.000000 0.000000 0.000000 Cu\n-0.000000 0.000000 0.500000 Cu\n-0.000000 0.500000 0.000000 Cu\n0.126176 0.376176 0.252354 O\n0.376176 0.126177 0.752354 O\n0.873823 0.623824 0.747647 O\n0.623823 0.873823 0.247647 O\n",
"nsites": 10,
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"elements": [
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"volume": 149.13944950365266,
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"formula_full": "Sr2 Cu4 O4",
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"formula_anonymous": "AB2C2",
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"spacegroup": 141
},
{
"id": "jvasp-16068",
"created_at": "2022-09-04T14:36:40.602284Z",
"updated_at": "2022-09-04T14:36:40.602303Z",
"structure_string": "Ca1 P2 Rh2\n1.0\n3.776311 0.000000 -1.450274\n-0.556971 3.735011 -1.450274\n0.005393 0.006257 5.655672\nCa P Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.615822 0.615822 0.231644 P\n0.384178 0.384179 0.768357 P\n0.250000 0.750000 0.500001 Rh\n0.750000 0.250000 0.500001 Rh\n",
"nsites": 5,
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"volume": 79.8393172599412,
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"formula_full": "Ca1 P2 Rh2",
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"spacegroup": 139
},
{
"id": "jvasp-2466",
"created_at": "2022-09-04T14:36:49.166095Z",
"updated_at": "2022-09-04T14:36:49.166107Z",
"structure_string": "Ca1 Mg2 N2\n1.0\n1.771303 -3.067986 0.000000\n1.771303 3.067986 0.000000\n0.000000 0.000000 6.079305\nCa Mg N\n1 2 2\ndirect\n0.000000 0.000000 0.500000 Ca\n0.333332 0.666666 0.858950 Mg\n0.666666 0.333332 0.141049 Mg\n0.333332 0.666666 0.233668 N\n0.666666 0.333332 0.766331 N\n",
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},
{
"id": "jvasp-15091",
"created_at": "2022-09-04T14:36:40.198924Z",
"updated_at": "2022-09-04T14:36:40.198960Z",
"structure_string": "Nd1 Si2 Cu2\n1.0\n3.836282 0.000000 -1.453573\n-0.550761 3.796540 -1.453573\n-0.005830 -0.006736 5.773774\nNd Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.620937 0.620937 0.241875 Si\n0.379062 0.379062 0.758125 Si\n0.750000 0.249999 0.500000 Cu\n0.250000 0.749999 0.500000 Cu\n",
"nsites": 5,
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"formula_full": "Nd1 Si2 Cu2",
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},
{
"id": "jvasp-2766",
"created_at": "2022-09-04T14:36:40.998091Z",
"updated_at": "2022-09-04T14:36:40.998124Z",
"structure_string": "Ba1 Cd2 As2\n1.0\n2.291182 -3.968443 0.000000\n2.291182 3.968443 0.000000\n0.000000 0.000000 7.726782\nBa Cd As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666666 0.333333 0.368888 Cd\n0.333333 0.666666 0.631112 Cd\n0.666666 0.333333 0.738445 As\n0.333333 0.666666 0.261555 As\n",
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"density": 6.05067813880017,
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"volume": 140.51037427402625,
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"formula_full": "Ba1 Cd2 As2",
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"formula_anonymous": "AB2C2",
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"spacegroup": 164
},
{
"id": "jvasp-15322",
"created_at": "2022-09-04T14:36:45.826840Z",
"updated_at": "2022-09-04T14:36:45.826860Z",
"structure_string": "Sc1 Co2 Si2\n1.0\n3.554620 -0.000000 -1.294907\n-0.471720 3.523180 -1.294907\n-0.010191 -0.011646 5.498331\nSc Co Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750000 0.249999 0.499999 Co\n0.250000 0.749999 0.499999 Co\n0.623976 0.623976 0.247953 Si\n0.376023 0.376023 0.752045 Si\n",
"nsites": 5,
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"volume": 68.75149922146214,
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"formula_full": "Sc1 Co2 Si2",
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"spacegroup": 139
},
{
"id": "jvasp-102630",
"created_at": "2022-09-04T14:36:55.307058Z",
"updated_at": "2022-09-04T14:36:55.307069Z",
"structure_string": "Ba1 Ga2 H2\n1.0\n4.549723 0.000000 0.000000\n-2.274862 3.940176 0.000000\n-0.000000 -0.000000 4.963279\nBa Ga H\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333334 0.666667 0.471594 Ga\n0.666667 0.333334 0.528406 Ga\n0.333334 0.666667 0.128160 H\n0.666667 0.333334 0.871840 H\n",
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"formula_full": "Ba1 Ga2 H2",
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},
{
"id": "jvasp-11530",
"created_at": "2022-09-04T14:36:45.755302Z",
"updated_at": "2022-09-04T14:36:45.755318Z",
"structure_string": "Zn4 Cu2 N4\n1.0\n3.262997 0.000000 1.311379\n0.996953 5.379783 2.234574\n-0.851714 -0.181908 6.834462\nZn Cu N\n4 2 4\ndirect\n0.653275 0.188977 0.504476 Zn\n0.346727 0.811022 0.495523 Zn\n0.087910 0.602294 0.221885 Zn\n0.912091 0.397705 0.778115 Zn\n0.369666 0.160994 0.099675 Cu\n0.630335 0.839006 0.900324 Cu\n0.199032 0.241699 0.360237 N\n0.800969 0.758300 0.639762 N\n0.484648 0.224565 0.806140 N\n0.515354 0.775434 0.193859 N\n",
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"formula_full": "Zn4 Cu2 N4",
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{
"id": "jvasp-2586",
"created_at": "2022-09-04T14:36:53.875061Z",
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"structure_string": "Th2 Te1 N2\n1.0\n3.944206 0.000000 -1.183574\n-0.355166 3.928183 -1.183574\n0.003381 0.003701 7.174997\nTh Te N\n2 1 2\ndirect\n0.337209 0.337209 0.674417 Th\n0.662791 0.662791 0.325584 Th\n0.000000 0.000000 0.000000 Te\n0.750000 0.250000 0.500001 N\n0.249999 0.749999 0.500001 N\n",
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