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{
"id": "jvasp-78528",
"created_at": "2022-09-04T14:36:31.441774Z",
"updated_at": "2022-09-04T14:36:31.441802Z",
"structure_string": "Er1 Cd2\n1.0\n-1.156444 -0.667673 -3.099173\n-3.316824 -4.757876 -1.411575\n-2.462029 4.264359 0.000000\nEr Cd\n1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.166529 0.333339 0.666670 Cd\n0.833469 0.666661 0.333329 Cd\n",
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"volume": 70.85734080451164,
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{
"id": "jvasp-78492",
"created_at": "2022-09-04T14:37:09.244611Z",
"updated_at": "2022-09-04T14:37:09.244628Z",
"structure_string": "Er1 Cd2\n1.0\n-1.045322 -0.603517 -3.151904\n-3.262770 -4.726591 -1.626909\n-2.461962 4.264243 -0.000000\nEr Cd\n1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.166719 0.333307 0.666654 Cd\n0.833280 0.666693 0.333345 Cd\n",
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{
"id": "jvasp-16472",
"created_at": "2022-09-04T14:37:38.250585Z",
"updated_at": "2022-09-04T14:37:38.250611Z",
"structure_string": "Er1 Cd2\n1.0\n2.462299 -4.264827 0.000000\n2.462299 4.264827 0.000000\n0.000000 -0.000000 3.372807\nEr Cd\n1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.333333 0.666667 0.500000 Cd\n0.666667 0.333333 0.500000 Cd\n",
"nsites": 3,
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"elements": [
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"volume": 70.83757637577034,
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"formula_full": "Er1 Cd2",
"formula_reduced": "ErCd2",
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"spacegroup": 191
},
{
"id": "jvasp-91835",
"created_at": "2022-09-04T14:35:50.206690Z",
"updated_at": "2022-09-04T14:35:50.206717Z",
"structure_string": "Er2 Cd4 Cu2\n1.0\n4.594454 0.000000 0.000000\n-0.000000 5.789575 -2.439581\n0.000000 -0.017814 6.282550\nEr Cd Cu\n2 4 2\ndirect\n0.250000 0.859324 0.140677 Er\n0.749999 0.140677 0.859324 Er\n0.749999 0.194934 0.386231 Cd\n0.250000 0.805067 0.613770 Cd\n0.749999 0.613770 0.805067 Cd\n0.250000 0.386231 0.194934 Cd\n0.749999 0.679994 0.320007 Cu\n0.250000 0.320008 0.679994 Cu\n",
"nsites": 8,
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"elements": [
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],
"chemical_system": "Cd-Cu-Er",
"density": 9.065488335296493,
"density_atomic": 0.047928368452405105,
"volume": 166.9157590445487,
"volume_molar": 12.564877450356443,
"formula_full": "Er2 Cd4 Cu2",
"formula_reduced": "ErCd2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-15787",
"created_at": "2022-09-04T14:35:56.196139Z",
"updated_at": "2022-09-04T14:35:56.196165Z",
"structure_string": "Er2 Cd6\n1.0\n4.835567 0.000000 0.000000\n0.000000 5.932612 -2.540654\n-0.000000 -0.042782 6.453602\nEr Cd\n2 6\ndirect\n0.250000 0.635081 0.364919 Er\n0.750001 0.364919 0.635081 Er\n0.750001 0.875959 0.686888 Cd\n0.250000 0.124041 0.313113 Cd\n0.750001 0.823393 0.176607 Cd\n0.250000 0.176607 0.823393 Cd\n0.750001 0.313113 0.124041 Cd\n0.250000 0.686887 0.875959 Cd\n",
"nsites": 8,
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"elements": [
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"chemical_system": "Cd-Er",
"density": 9.075541421432261,
"density_atomic": 0.04333403735398213,
"volume": 184.61238528620157,
"volume_molar": 13.897022127910734,
"formula_full": "Er2 Cd6",
"formula_reduced": "ErCd3",
"formula_anonymous": "AB3",
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"spacegroup": 63
},
{
"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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"elements": [
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],
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"density": 9.960008816999217,
"density_atomic": 0.048429390567048286,
"volume": 82.59447317352016,
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"formula_full": "Er1 Cd1 Ag2",
"formula_reduced": "ErCdAg2",
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"spacegroup": 225
},
{
"id": "jvasp-105164",
"created_at": "2022-09-04T14:36:55.333180Z",
"updated_at": "2022-09-04T14:36:55.333208Z",
"structure_string": "Er1 Cd1 Au2\n1.0\n4.238569 -0.000000 2.447139\n1.412856 3.996161 2.447139\n-0.000000 0.000000 4.894278\nEr Cd Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.500001 0.500000 0.500000 Cd\n0.750001 0.750000 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
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"elements": [
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"Au"
],
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"density": 13.492807690868089,
"density_atomic": 0.04825131155496393,
"volume": 82.89930099503158,
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"formula_full": "Er1 Cd1 Au2",
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},
{
"id": "jvasp-7731",
"created_at": "2022-09-04T14:36:41.313067Z",
"updated_at": "2022-09-04T14:36:41.313102Z",
"structure_string": "Er1 Cd1 Cu4\n1.0\n4.402119 -0.000000 2.541565\n1.467373 4.150358 2.541565\n-0.000000 -0.000000 5.083130\nEr Cd Cu\n1 1 4\ndirect\n0.750000 0.750000 0.749999 Er\n0.000000 0.000000 0.000000 Cd\n0.876786 0.374405 0.374403 Cu\n0.374404 0.374405 0.374404 Cu\n0.374404 0.374405 0.876785 Cu\n0.374404 0.876786 0.374403 Cu\n",
"nsites": 6,
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"density": 9.545376077112124,
"density_atomic": 0.06460597657416177,
"volume": 92.87066488519908,
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"formula_full": "Er1 Cd1 Cu4",
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"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-90182",
"created_at": "2022-09-04T14:35:53.170679Z",
"updated_at": "2022-09-04T14:35:53.170700Z",
"structure_string": "Er3 Cd3 Ga3\n1.0\n0.000000 0.000000 -4.334446\n-3.595830 -6.228161 0.000000\n-3.595815 6.228151 0.000000\nEr Cd Ga\n3 3 3\ndirect\n0.500000 0.577573 0.000000 Er\n0.500000 0.422401 0.422413 Er\n0.500000 0.999989 0.577588 Er\n0.000000 0.251097 0.000000 Cd\n0.000000 0.748883 0.748891 Cd\n0.000000 0.999990 0.251109 Cd\n0.000000 0.333324 0.666668 Ga\n0.000000 0.666656 0.333333 Ga\n0.500000 0.999988 0.000000 Ga\n",
"nsites": 9,
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"elements": [
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"chemical_system": "Cd-Er-Ga",
"density": 8.965267079328354,
"density_atomic": 0.04635762621578044,
"volume": 194.14281391604862,
"volume_molar": 12.990615032721461,
"formula_full": "Er3 Cd3 Ga3",
"formula_reduced": "ErCdGa",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-101395",
"created_at": "2022-09-04T14:36:34.953247Z",
"updated_at": "2022-09-04T14:36:34.953269Z",
"structure_string": "Er1 Cd1 Hg2\n1.0\n4.371229 0.000000 2.523729\n1.457076 4.121234 2.523729\n0.000000 0.000000 5.047460\nEr Cd Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.500001 0.500000 0.500000 Cd\n0.250000 0.250000 0.250000 Hg\n0.750001 0.749999 0.750000 Hg\n",
"nsites": 4,
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],
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"volume": 90.92927302351477,
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"formula_anonymous": "ABC2",
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{
"id": "jvasp-93664",
"created_at": "2022-09-04T14:35:49.603010Z",
"updated_at": "2022-09-04T14:35:49.603036Z",
"structure_string": "Er1 Cd1 Ni4\n1.0\n-3.497006 -3.497006 -0.000000\n-3.497006 0.000000 -3.497006\n0.000000 -3.497006 -3.497006\nEr Cd Ni\n1 1 4\ndirect\n0.750001 0.750001 0.750001 Er\n0.000000 0.000000 0.000000 Cd\n0.877070 0.374311 0.374311 Ni\n0.374311 0.877070 0.374311 Ni\n0.374311 0.374311 0.877070 Ni\n0.374311 0.374311 0.374311 Ni\n",
"nsites": 6,
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"formula_full": "Er1 Cd1 Ni4",
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"spacegroup": 216
},
{
"id": "jvasp-40971",
"created_at": "2022-09-04T14:37:59.364528Z",
"updated_at": "2022-09-04T14:37:59.364557Z",
"structure_string": "Er1 Cd1 Pd2\n1.0\n-0.000000 3.360753 3.360753\n3.360753 0.000000 3.360753\n3.360753 3.360753 0.000000\nEr Cd Pd\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Er\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n",
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}
]
}