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{
"id": "jvasp-92632",
"created_at": "2022-09-04T14:36:32.196639Z",
"updated_at": "2022-09-04T14:36:32.196665Z",
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{
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"structure_string": "Th1 Cr2 Ge2\n1.0\n3.897591 -0.000000 -1.382906\n-0.490669 3.866582 -1.382906\n-0.025973 -0.029477 6.110750\nTh Cr Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.250000 0.749999 0.499999 Cr\n0.750000 0.249999 0.499999 Cr\n0.624497 0.624496 0.248994 Ge\n0.375503 0.375502 0.751005 Ge\n",
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{
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"created_at": "2022-09-04T14:36:33.784133Z",
"updated_at": "2022-09-04T14:36:33.784155Z",
"structure_string": "Li2 V1 N2\n1.0\n2.972622 0.000286 -0.000055\n-1.486363 2.573945 -0.000316\n-0.000655 -0.000861 5.438779\nLi V N\n2 1 2\ndirect\n0.666647 0.333313 0.365259 Li\n0.333357 0.666691 0.634741 Li\n0.000000 0.000000 0.000000 V\n0.666829 0.333525 0.786166 N\n0.333175 0.666479 0.213834 N\n",
"nsites": 5,
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"elements": [
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"formula_full": "Li2 V1 N2",
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},
{
"id": "jvasp-103131",
"created_at": "2022-09-04T14:36:38.303194Z",
"updated_at": "2022-09-04T14:36:38.303213Z",
"structure_string": "Mg1 Al2 Ge2\n1.0\n4.124640 0.000000 -0.000000\n-2.062321 3.572043 0.000000\n-0.000000 0.000000 6.840400\nMg Al Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666667 0.333333 0.368665 Al\n0.333333 0.666666 0.631335 Al\n0.666667 0.333333 0.760295 Ge\n0.333333 0.666666 0.239705 Ge\n",
"nsites": 5,
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"elements": [
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],
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"density": 3.6832891224899442,
"density_atomic": 0.049611890741587436,
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"formula_full": "Mg1 Al2 Ge2",
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"formula_anonymous": "AB2C2",
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"spacegroup": 164
},
{
"id": "jvasp-43114",
"created_at": "2022-09-04T14:36:36.151578Z",
"updated_at": "2022-09-04T14:36:36.151602Z",
"structure_string": "Li2 Fe1 O2\n1.0\n3.088222 -0.000000 -0.000000\n-1.544111 2.672472 0.000344\n-0.000000 -0.001372 5.236962\nLi Fe O\n2 1 2\ndirect\n0.333264 0.666610 0.636585 Li\n0.666655 0.333390 0.363413 Li\n0.999959 0.000000 0.000000 Fe\n0.333195 0.666471 0.245662 O\n0.666724 0.333529 0.754337 O\n",
"nsites": 5,
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"elements": [
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"O"
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"density_atomic": 0.11568282638889113,
"volume": 43.22162723783643,
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"formula_full": "Li2 Fe1 O2",
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"spacegroup": 164
},
{
"id": "jvasp-101451",
"created_at": "2022-09-04T14:36:38.680334Z",
"updated_at": "2022-09-04T14:36:38.680356Z",
"structure_string": "Sm1 Zn2 Ga2\n1.0\n3.921113 -0.007604 -4.708871\n-0.519182 3.886597 -4.708871\n0.006669 0.007604 6.127687\nSm Zn Ga\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.750000 0.250000 0.500001 Zn\n0.250000 0.750000 0.500001 Zn\n0.614083 0.614084 0.000001 Ga\n0.385917 0.385918 0.000001 Ga\n",
"nsites": 5,
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"elements": [
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"density": 7.458881746089838,
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"formula_full": "Sm1 Zn2 Ga2",
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},
{
"id": "jvasp-14312",
"created_at": "2022-09-04T14:36:32.932877Z",
"updated_at": "2022-09-04T14:36:32.932911Z",
"structure_string": "Sr1 Mn2 Ge2\n1.0\n3.813848 -0.000000 -1.398466\n-0.512791 3.779218 -1.398466\n0.191913 0.219712 6.423110\nSr Mn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.750000 0.499999 Mn\n0.750000 0.250000 0.499999 Mn\n0.633941 0.633941 0.267880 Ge\n0.366059 0.366059 0.732118 Ge\n",
"nsites": 5,
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"volume": 94.92229906570604,
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},
{
"id": "jvasp-92627",
"created_at": "2022-09-04T14:36:20.473624Z",
"updated_at": "2022-09-04T14:36:20.473650Z",
"structure_string": "Tm2 In1 Ni2\n1.0\n0.000000 0.000000 -3.589011\n-3.865444 0.000000 0.000000\n1.932722 7.055593 0.000000\nTm In Ni\n2 1 2\ndirect\n0.500000 0.639217 0.278436 Tm\n0.500000 0.360783 0.721564 Tm\n0.000000 0.000000 0.000000 In\n0.000000 0.802230 0.604461 Ni\n0.000000 0.197770 0.395538 Ni\n",
"nsites": 5,
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"elements": [
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"density": 9.67101465440143,
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"volume": 97.88309566893591,
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"formula_full": "Tm2 In1 Ni2",
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"formula_anonymous": "AB2C2",
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"spacegroup": 65
},
{
"id": "jvasp-16157",
"created_at": "2022-09-04T14:36:32.093348Z",
"updated_at": "2022-09-04T14:36:32.093373Z",
"structure_string": "Ba1 Ni2 P2\n1.0\n3.770542 0.000000 -1.194257\n-0.378260 3.751521 -1.194257\n0.012282 0.013582 6.588140\nBa Ni P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.749999 0.499999 Ni\n0.749999 0.250000 0.499999 Ni\n0.657905 0.657905 0.315811 P\n0.342094 0.342094 0.684187 P\n",
"nsites": 5,
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"density": 5.635084823715819,
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"volume": 93.3133246140818,
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"formula_full": "Ba1 Ni2 P2",
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"formula_anonymous": "AB2C2",
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},
{
"id": "jvasp-2871",
"created_at": "2022-09-04T14:36:32.866162Z",
"updated_at": "2022-09-04T14:36:32.866182Z",
"structure_string": "Ca2 Zn1 N2\n1.0\n3.448390 0.000000 -0.939307\n-0.255858 3.438884 -0.939307\n-0.002687 -0.002894 6.789661\nCa Zn N\n2 1 2\ndirect\n0.663450 0.663450 0.326901 Ca\n0.336549 0.336550 0.673098 Ca\n0.000000 0.000000 0.000000 Zn\n0.853517 0.853518 0.707036 N\n0.146482 0.146482 0.292963 N\n",
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"formula_full": "Ca2 Zn1 N2",
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},
{
"id": "jvasp-93278",
"created_at": "2022-09-04T14:36:19.317240Z",
"updated_at": "2022-09-04T14:36:19.317272Z",
"structure_string": "Ho1 Co2 B2\n1.0\n3.335535 -0.000026 -1.195496\n-0.428522 3.307899 -1.195500\n0.007114 0.008090 5.270599\nHo Co B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.249999 0.750002 0.500000 Co\n0.750002 0.249997 0.499999 Co\n0.351880 0.351880 0.703725 B\n0.648121 0.648119 0.296274 B\n",
"nsites": 5,
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"volume": 58.21822787115035,
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{
"id": "jvasp-92625",
"created_at": "2022-09-04T14:36:20.233812Z",
"updated_at": "2022-09-04T14:36:20.233832Z",
"structure_string": "Lu2 In1 Ni2\n1.0\n0.000000 0.000000 -3.554188\n-3.848151 0.000000 0.000000\n1.924075 7.021202 0.000000\nLu In Ni\n2 1 2\ndirect\n0.500000 0.640034 0.280069 Lu\n0.500000 0.359965 0.719931 Lu\n0.000000 0.000000 0.000000 In\n0.000000 0.802769 0.605539 Ni\n0.000000 0.197230 0.394460 Ni\n",
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"formula_full": "Lu2 In1 Ni2",
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