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{
"id": "jvasp-2895",
"created_at": "2022-09-04T14:36:34.530094Z",
"updated_at": "2022-09-04T14:36:34.530111Z",
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{
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"structure_string": "Tb2 Sb1 O2\n1.0\n-1.931987 1.931987 6.651223\n1.931987 -1.931987 6.651223\n1.931987 1.931987 -6.651223\nTb Sb O\n2 1 2\ndirect\n0.335457 0.335457 0.000000 Tb\n0.664542 0.664542 0.000000 Tb\n0.000000 0.000000 0.000000 Sb\n0.750001 0.250000 0.500001 O\n0.250000 0.750001 0.500001 O\n",
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{
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"structure_string": "Y2 C1 I2\n1.0\n3.861678 -0.000000 -0.000000\n-1.930839 3.344312 0.000000\n-0.000000 0.000000 10.484228\nY C I\n2 1 2\ndirect\n0.333333 0.666667 0.125222 Y\n0.666667 0.333333 0.874778 Y\n0.000000 0.000000 0.000000 C\n0.333333 0.666667 0.669092 I\n0.666667 0.333333 0.330908 I\n",
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{
"id": "jvasp-92476",
"created_at": "2022-09-04T14:36:20.727004Z",
"updated_at": "2022-09-04T14:36:20.727019Z",
"structure_string": "Sr1 Mg2 As2\n1.0\n4.420560 -0.000004 -0.000000\n-2.210284 3.828318 0.000001\n-0.000000 0.000000 7.405538\nSr Mg As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666668 0.333334 0.370909 Mg\n0.333334 0.666668 0.629091 Mg\n0.333336 0.666668 0.260753 As\n0.666668 0.333334 0.739248 As\n",
"nsites": 5,
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"elements": [
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],
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"density": 3.790396030946513,
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"volume": 125.3261455079807,
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"formula_full": "Sr1 Mg2 As2",
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{
"id": "jvasp-92268",
"created_at": "2022-09-04T14:36:12.470691Z",
"updated_at": "2022-09-04T14:36:12.470710Z",
"structure_string": "Ca1 Zn2 N2\n1.0\n3.466670 0.000003 0.000003\n-1.733333 3.002220 -0.000000\n0.000005 0.000003 6.031668\nCa Zn N\n1 2 2\ndirect\n-0.000001 -0.000000 0.500000 Ca\n0.666668 0.333333 0.140678 Zn\n0.333331 0.666665 0.859322 Zn\n0.666663 0.333331 0.758033 N\n0.333336 0.666667 0.241966 N\n",
"nsites": 5,
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"elements": [
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"Zn",
"N"
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"volume": 62.77585864284928,
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{
"id": "jvasp-96775",
"created_at": "2022-09-04T14:36:33.615926Z",
"updated_at": "2022-09-04T14:36:33.615940Z",
"structure_string": "La1 Si2 Pt2\n1.0\n4.027096 0.000000 -1.603558\n-0.638524 3.976152 -1.603558\n-0.005132 -0.006022 5.845614\nLa Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 La\n0.623994 0.623992 0.247984 Si\n0.376009 0.376008 0.752015 Si\n0.250001 0.750000 0.500000 Pt\n0.750001 0.250000 0.500000 Pt\n",
"nsites": 5,
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"elements": [
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"formula_full": "La1 Si2 Pt2",
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{
"id": "jvasp-15325",
"created_at": "2022-09-04T14:36:37.967115Z",
"updated_at": "2022-09-04T14:36:37.967147Z",
"structure_string": "Ho1 Si2 Pd2\n1.0\n3.881890 0.000000 -1.488207\n-0.570536 3.839734 -1.488207\n-0.012013 -0.013930 5.775595\nHo Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.616613 0.616613 0.233226 Si\n0.383387 0.383386 0.766773 Si\n0.750000 0.250000 0.500000 Pd\n0.250000 0.749999 0.500000 Pd\n",
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"formula_full": "Ho1 Si2 Pd2",
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{
"id": "jvasp-86396",
"created_at": "2022-09-04T14:36:12.937445Z",
"updated_at": "2022-09-04T14:36:12.937480Z",
"structure_string": "Nd1 Cu2 Ge2\n1.0\n3.916162 -0.000000 -1.414946\n-0.511233 3.882649 -1.414946\n-0.073249 -0.083526 5.924142\nNd Cu Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.250000 0.750000 0.499999 Cu\n0.750000 0.250000 0.499999 Cu\n0.622700 0.622700 0.245400 Ge\n0.377300 0.377299 0.754599 Ge\n",
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},
{
"id": "jvasp-99185",
"created_at": "2022-09-04T14:36:34.097808Z",
"updated_at": "2022-09-04T14:36:34.097820Z",
"structure_string": "Ba8 H16 O16\n1.0\n9.009845 0.000000 -0.961050\n0.000000 8.102666 0.000000\n-0.034668 0.000000 6.944317\nBa H O\n8 16 16\ndirect\n0.899086 0.125246 0.256650 Ba\n0.399085 0.374755 0.756650 Ba\n0.100915 0.874755 0.743350 Ba\n0.600915 0.625246 0.243350 Ba\n0.334116 0.031074 0.247074 Ba\n0.834116 0.468926 0.747074 Ba\n0.665884 0.968927 0.752926 Ba\n0.165884 0.531074 0.252926 Ba\n0.096608 0.241618 0.559085 H\n0.596609 0.258382 0.059085 H\n0.903392 0.758383 0.440915 H\n0.403392 0.741618 0.940916 H\n0.129247 0.268891 0.948843 H\n0.370753 0.768891 0.551158 H\n0.870753 0.731110 0.051158 H\n0.629247 0.231109 0.448842 H\n0.969091 0.159328 0.779630 H\n0.530909 0.659329 0.720371 H\n0.030909 0.840672 0.220371 H\n0.792841 0.402494 0.105868 H\n0.292840 0.097507 0.605868 H\n0.207160 0.597507 0.894133 H\n0.707160 0.902494 0.394133 H\n0.469091 0.340672 0.279629 H\n0.824166 0.748559 0.527020 O\n0.324166 0.751442 0.027019 O\n0.601877 0.342632 0.487600 O\n0.101876 0.157368 0.987601 O\n0.398124 0.657368 0.512400 O\n0.898124 0.842632 0.012400 O\n0.409191 0.350158 0.150348 O\n0.870397 0.478165 0.167436 O\n0.590809 0.649843 0.849652 O\n0.090809 0.850158 0.349652 O\n0.370397 0.021836 0.667436 O\n0.129603 0.521836 0.832565 O\n0.629603 0.978165 0.332564 O\n0.675834 0.248559 0.972981 O\n0.909191 0.149843 0.650349 O\n0.175834 0.251442 0.472981 O\n",
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"formula_full": "Ba8 H16 O16",
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},
{
"id": "jvasp-100270",
"created_at": "2022-09-04T14:36:35.125697Z",
"updated_at": "2022-09-04T14:36:35.125725Z",
"structure_string": "Tb4 Co2 Si4\n1.0\n5.027824 0.000090 2.564525\n3.311862 3.782935 2.564525\n0.019499 0.008845 10.046327\nTb Co Si\n4 2 4\ndirect\n0.001834 0.001833 0.328238 Tb\n-0.001833 -0.001835 0.671762 Tb\n0.813689 0.813688 0.105000 Tb\n0.186312 0.186310 0.895000 Tb\n0.726637 0.726635 0.621536 Co\n0.273364 0.273362 0.378464 Co\n0.654853 0.654852 0.432729 Si\n0.345147 0.345146 0.567271 Si\n0.504891 0.504890 0.127164 Si\n0.495110 0.495107 0.872835 Si\n",
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"volume": 190.8493684514607,
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"spacegroup": 12
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{
"id": "jvasp-14890",
"created_at": "2022-09-04T14:36:34.929094Z",
"updated_at": "2022-09-04T14:36:34.929110Z",
"structure_string": "Co1 B2 W2\n1.0\n2.986417 0.000000 1.126908\n0.874457 3.852989 2.203206\n-0.001184 0.008166 4.523743\nCo B W\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.500001 0.703939 0.296062 B\n0.500002 0.296062 0.703938 B\n0.798770 0.701233 0.701232 W\n0.201233 0.298768 0.298768 W\n",
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{
"id": "jvasp-15748",
"created_at": "2022-09-04T14:36:10.220065Z",
"updated_at": "2022-09-04T14:36:10.220095Z",
"structure_string": "Sm1 Al2 Si2\n1.0\n2.118352 -3.669093 0.000000\n2.118352 3.669093 -0.000000\n0.000000 0.000000 6.739725\nSm Al Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.666667 0.333333 0.643473 Al\n0.333333 0.666667 0.356526 Al\n0.666667 0.333333 0.264949 Si\n0.333333 0.666667 0.735050 Si\n",
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}