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{
"id": "jvasp-9784",
"created_at": "2022-09-04T14:37:12.190794Z",
"updated_at": "2022-09-04T14:37:12.190811Z",
"structure_string": "Cd4 Ga2 Ag2 S8\n1.0\n6.679733 0.000000 0.000000\n0.000000 6.961780 0.000000\n0.000000 0.000000 8.189083\nCd Ga Ag S\n4 2 2 8\ndirect\n0.486435 0.175441 0.252610 Cd\n0.986434 0.824559 0.752609 Cd\n0.486435 0.175441 0.747390 Cd\n0.986434 0.824559 0.247390 Cd\n0.491122 0.676937 0.500000 Ga\n0.991122 0.323063 0.000000 Ga\n0.989857 0.341004 0.500000 Ag\n0.489858 0.658996 0.000000 Ag\n0.107936 0.634532 0.000000 S\n0.607936 0.365468 0.500000 S\n0.146462 0.677704 0.500000 S\n0.646461 0.322296 0.000000 S\n0.603756 0.824708 0.265588 S\n0.103757 0.175292 0.765588 S\n0.103757 0.175292 0.234411 S\n0.603756 0.824708 0.734411 S\n",
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{
"id": "jvasp-79082",
"created_at": "2022-09-04T14:36:38.174216Z",
"updated_at": "2022-09-04T14:36:38.174234Z",
"structure_string": "Er1 Cd1 Ag2\n1.0\n-0.000000 3.456530 3.456530\n3.456530 0.000000 3.456530\n3.456530 3.456530 0.000000\nEr Cd Ag\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Er\n0.250001 0.250001 0.250001 Cd\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
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"formula_full": "Er1 Cd1 Ag2",
"formula_reduced": "ErCdAg2",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-40355",
"created_at": "2022-09-04T14:38:33.731696Z",
"updated_at": "2022-09-04T14:38:33.731730Z",
"structure_string": "Dy1 Cd1 Ag2\n1.0\n0.000000 3.475402 3.475402\n3.475402 -0.000000 3.475402\n3.475402 3.475402 -0.000000\nDy Cd Ag\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Dy\n0.249999 0.249999 0.249999 Cd\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
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"elements": [
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"density": 9.704506684045999,
"density_atomic": 0.04764472839589662,
"volume": 83.95472352707331,
"volume_molar": 12.639679063672979,
"formula_full": "Dy1 Cd1 Ag2",
"formula_reduced": "DyCdAg2",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-8740",
"created_at": "2022-09-04T14:36:48.991222Z",
"updated_at": "2022-09-04T14:36:48.991248Z",
"structure_string": "Ce1 Cd2 Ag1\n1.0\n4.400414 -0.000000 2.540581\n1.466805 4.148750 2.540581\n-0.000000 -0.000000 5.081160\nCe Cd Ag\n1 2 1\ndirect\n0.499999 0.500000 0.500000 Ce\n0.250000 0.250000 0.250000 Cd\n0.749999 0.750000 0.750001 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Ag-Cd-Ce",
"density": 8.46366736613869,
"density_atomic": 0.04312075115962488,
"volume": 92.76276253149568,
"volume_molar": 13.965760331278023,
"formula_full": "Ce1 Cd2 Ag1",
"formula_reduced": "CeCd2Ag",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-79961",
"created_at": "2022-09-04T14:36:45.560387Z",
"updated_at": "2022-09-04T14:36:45.560411Z",
"structure_string": "Ce1 Cd1 Ag2\n1.0\n-0.000002 3.543301 3.542158\n3.543310 0.000004 3.542152\n3.543310 3.543297 0.000004\nCe Cd Ag\n1 1 2\ndirect\n0.749998 0.750000 0.749999 Ce\n0.249999 0.249999 0.250000 Cd\n0.499999 0.499999 0.500000 Ag\n-0.000000 0.999999 1.000000 Ag\n",
"nsites": 4,
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"elements": [
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],
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"density": 8.742289233224884,
"density_atomic": 0.0449723778072824,
"volume": 88.94348475726534,
"volume_molar": 13.390754622329158,
"formula_full": "Ce1 Cd1 Ag2",
"formula_reduced": "CeCdAg2",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-106108",
"created_at": "2022-09-04T14:36:19.928267Z",
"updated_at": "2022-09-04T14:36:19.928299Z",
"structure_string": "Cd1 Ag1\n1.0\n3.058762 0.077976 0.000000\n-1.595730 2.610699 0.000000\n0.000000 0.000000 4.761701\nCd Ag\n1 1\ndirect\n0.333251 0.666750 0.500000 Cd\n0.666750 0.333252 0.000000 Ag\n",
"nsites": 2,
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"elements": [
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"density": 9.472029990246773,
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"volume": 38.617088157030324,
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"spacegroup": 187
},
{
"id": "jvasp-109776",
"created_at": "2022-09-04T14:38:20.439565Z",
"updated_at": "2022-09-04T14:38:20.439592Z",
"structure_string": "Cd1 Ag1\n1.0\n3.043812 0.507794 0.000000\n-0.544641 3.037435 0.000000\n0.000000 0.000000 4.031926\nCd Ag\n1 1\ndirect\n0.500000 0.499999 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
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"elements": [
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"density": 9.527617134131681,
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"volume": 38.39178380174604,
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"formula_full": "Cd1 Ag1",
"formula_reduced": "CdAg",
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"spacegroup": 123
},
{
"id": "jvasp-106372",
"created_at": "2022-09-04T14:38:40.227804Z",
"updated_at": "2022-09-04T14:38:40.227834Z",
"structure_string": "Cd1 Ag1\n1.0\n2.894306 -0.009336 4.218387\n1.301145 2.585365 4.218387\n-0.015205 -0.009336 5.115815\nCd Ag\n1 1\ndirect\n0.500001 0.499999 0.500001 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
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"elements": [
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"chemical_system": "Ag-Cd",
"density": 9.483071411448753,
"density_atomic": 0.051850915471466856,
"volume": 38.57212513635529,
"volume_molar": 11.614338349173288,
"formula_full": "Cd1 Ag1",
"formula_reduced": "CdAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.35632125,
"spacegroup": 166
},
{
"id": "jvasp-111256",
"created_at": "2022-09-04T14:38:48.688517Z",
"updated_at": "2022-09-04T14:38:48.688544Z",
"structure_string": "Cd1 Ag3\n1.0\n4.185893 -0.000000 0.000000\n0.000000 4.185893 0.000000\n0.000000 -0.000000 4.185893\nCd Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n-0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 -0.000000 Ag\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Ag-Cd",
"density": 9.871581998993937,
"density_atomic": 0.05453754988800185,
"volume": 73.34396224645933,
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"formula_full": "Cd1 Ag3",
"formula_reduced": "CdAg3",
"formula_anonymous": "AB3",
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"spacegroup": 221
},
{
"id": "jvasp-39834",
"created_at": "2022-09-04T14:37:34.722260Z",
"updated_at": "2022-09-04T14:37:34.722287Z",
"structure_string": "Cd2 Ag6\n1.0\n2.952490 -5.113863 0.000000\n2.952490 5.113863 -0.000000\n0.000000 0.000000 4.841673\nCd Ag\n2 6\ndirect\n0.666667 0.333333 0.750000 Cd\n0.333333 0.666667 0.250000 Cd\n0.834792 0.165208 0.250000 Ag\n0.834793 0.669586 0.250000 Ag\n0.330414 0.165208 0.250000 Ag\n0.165208 0.834792 0.750000 Ag\n0.165208 0.330414 0.750000 Ag\n0.669586 0.834793 0.750000 Ag\n",
"nsites": 8,
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"volume": 146.20525230452986,
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"formula_full": "Cd2 Ag6",
"formula_reduced": "CdAg3",
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"spacegroup": 194
},
{
"id": "jvasp-106234",
"created_at": "2022-09-04T14:36:41.659494Z",
"updated_at": "2022-09-04T14:36:41.659513Z",
"structure_string": "Cd1 Ag3\n1.0\n3.796999 -0.037386 -3.428673\n-0.774393 3.717380 -3.428673\n0.030708 0.037386 5.115863\nCd Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750001 0.250000 0.500001 Ag\n0.250001 0.750000 0.500001 Ag\n0.500000 0.499999 0.000001 Ag\n",
"nsites": 4,
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},
{
"id": "jvasp-14994",
"created_at": "2022-09-04T14:36:47.944262Z",
"updated_at": "2022-09-04T14:36:47.944288Z",
"structure_string": "Cd1 Ag1\n1.0\n3.372443 -0.000000 -0.000000\n0.000000 3.372443 0.000000\n0.000000 0.000000 3.372443\nCd Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
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"formula_full": "Cd1 Ag1",
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}