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"results": [
{
"id": "jvasp-2481",
"created_at": "2022-09-04T14:36:52.675337Z",
"updated_at": "2022-09-04T14:36:52.675358Z",
"structure_string": "Al2 Cd1 S4\n1.0\n5.039406 0.000000 -2.391539\n-1.134947 4.909939 -2.391539\n-0.022436 -0.028213 6.457964\nAl Cd S\n2 1 4\ndirect\n0.249999 0.750000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 -0.000000 Cd\n0.911596 0.904236 0.272058 S\n0.360461 0.367821 0.272058 S\n0.095763 0.639539 0.727941 S\n0.632179 0.088404 0.727941 S\n",
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{
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"structure_string": "Ca1 La1 Mg2\n1.0\n-0.000000 3.946240 3.946240\n3.946240 0.000000 3.946240\n3.946240 3.946240 0.000000\nCa La Mg\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Ca\n0.750001 0.750001 0.750001 La\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n",
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{
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"structure_string": "K3 Nb1 O8\n1.0\n5.701983 0.054175 -2.468960\n-3.257686 5.135345 -1.275548\n0.034368 -0.054175 6.213468\nK Nb O\n3 1 8\ndirect\n0.500000 0.250000 0.750000 K\n0.499999 0.750000 0.249999 K\n-0.000001 0.499999 0.500000 K\n0.000000 0.000000 0.000000 Nb\n0.569305 0.806106 0.806107 O\n-0.000000 0.193892 0.763199 O\n-0.000001 0.763198 0.193892 O\n0.430693 0.236801 0.236801 O\n0.285087 0.335633 0.335633 O\n-0.000001 0.664366 0.949453 O\n-0.000001 0.949453 0.664366 O\n0.714913 0.050547 0.050546 O\n",
"nsites": 12,
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{
"id": "jvasp-48105",
"created_at": "2022-09-04T14:36:08.663446Z",
"updated_at": "2022-09-04T14:36:08.663471Z",
"structure_string": "Li2 Co2 Si2 O8\n1.0\n0.000000 5.227809 -0.126674\n6.241417 0.000000 0.000000\n0.000000 -0.003399 -5.229059\nLi Co Si O\n2 2 2 8\ndirect\n0.316899 0.492046 0.316696 Li\n0.683101 0.992046 0.683304 Li\n0.164169 0.742036 0.835784 Co\n0.835831 0.242036 0.164215 Co\n0.327034 0.992061 0.327026 Si\n0.672966 0.492060 0.672973 Si\n0.185011 0.211245 0.226990 O\n0.227057 0.772878 0.184959 O\n0.292024 0.967959 0.640847 O\n0.359152 0.516160 0.707910 O\n0.640848 0.016159 0.292090 O\n0.707976 0.467958 0.359152 O\n0.772943 0.272878 0.815041 O\n0.814989 0.711245 0.773009 O\n",
"nsites": 14,
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"elements": [
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"Si",
"O"
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"chemical_system": "Co-Li-O-Si",
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"density_atomic": 0.08205305242298715,
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"formula_full": "Li2 Co2 Si2 O8",
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{
"id": "jvasp-27246",
"created_at": "2022-09-04T14:37:41.473665Z",
"updated_at": "2022-09-04T14:37:41.473686Z",
"structure_string": "Ni1 Cl2 O8\n1.0\n4.460860 -0.043126 6.174349\n1.965809 4.004587 6.174349\n-0.069963 -0.043126 7.616886\nNi Cl O\n1 2 8\ndirect\n0.000000 0.000000 0.000000 Ni\n0.251527 0.251526 0.251526 Cl\n0.748475 0.748473 0.748474 Cl\n0.262870 -0.008599 0.573025 O\n0.573025 0.262868 -0.008598 O\n-0.008597 0.573025 0.262869 O\n0.737132 0.008597 0.426976 O\n0.426976 0.737131 0.008598 O\n0.008599 0.426975 0.737131 O\n0.185278 0.185277 0.185278 O\n0.814724 0.814721 0.814723 O\n",
"nsites": 11,
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{
"id": "jvasp-116474",
"created_at": "2022-09-04T14:38:43.180505Z",
"updated_at": "2022-09-04T14:38:43.180538Z",
"structure_string": "Ti3 Be9\n1.0\n4.260929 0.002315 6.176037\n1.925459 3.801069 6.176037\n0.003765 0.002315 7.503261\nTi Be\n3 9\ndirect\n0.857454 0.857450 0.857452 Ti\n0.142548 0.142548 0.142548 Ti\n0.000000 0.000000 0.000000 Ti\n0.417783 0.921452 0.417782 Be\n0.417784 0.417780 0.921453 Be\n0.921455 0.417780 0.417782 Be\n0.582220 0.078545 0.582218 Be\n0.582219 0.582218 0.078547 Be\n0.078548 0.582218 0.582218 Be\n0.665933 0.665929 0.665931 Be\n0.334070 0.334069 0.334069 Be\n0.500001 0.499999 0.500000 Be\n",
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"volume": 121.36828558364762,
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"formula_full": "Ti3 Be9",
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{
"id": "jvasp-20248",
"created_at": "2022-09-04T14:37:44.784550Z",
"updated_at": "2022-09-04T14:37:44.784580Z",
"structure_string": "Ba4 Mg8\n1.0\n3.321968 -5.753818 0.000000\n3.321968 5.753818 0.000000\n-0.000000 -0.000000 10.508507\nBa Mg\n4 8\ndirect\n0.333333 0.666667 0.556619 Ba\n0.666667 0.333333 0.056619 Ba\n0.666667 0.333333 0.443381 Ba\n0.333333 0.666667 0.943381 Ba\n0.161847 0.838153 0.250000 Mg\n0.838154 0.676307 0.750000 Mg\n0.323694 0.161847 0.750000 Mg\n0.676307 0.838154 0.250000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.838153 0.161847 0.750000 Mg\n0.161847 0.323694 0.250000 Mg\n",
"nsites": 12,
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"elements": [
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"density": 3.0743430720323404,
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"volume": 401.7191903339488,
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"formula_full": "Ba4 Mg8",
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{
"id": "jvasp-1762",
"created_at": "2022-09-04T14:36:16.376186Z",
"updated_at": "2022-09-04T14:36:16.376207Z",
"structure_string": "Sr1 C1 N2\n1.0\n3.724712 0.021954 4.149025\n1.603913 3.361759 4.149025\n0.034573 0.021954 5.575543\nSr C N\n1 1 2\ndirect\n0.499999 0.499999 0.500000 Sr\n0.000000 0.000000 0.000000 C\n0.081018 0.081018 0.081018 N\n0.918981 0.918981 0.918982 N\n",
"nsites": 4,
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},
{
"id": "jvasp-10931",
"created_at": "2022-09-04T14:37:20.147058Z",
"updated_at": "2022-09-04T14:37:20.147087Z",
"structure_string": "Ca2 Mn2 F10\n1.0\n5.554740 0.018454 -0.025791\n-1.818123 5.251585 0.022890\n-2.753071 -2.001370 7.036071\nCa Mn F\n2 2 10\ndirect\n0.797742 0.544484 0.249685 Ca\n0.205796 0.452578 0.750050 Ca\n0.001777 0.998533 -0.000129 Mn\n0.501772 0.998526 0.499866 Mn\n0.838905 0.088055 0.751088 F\n0.164637 0.908979 0.248664 F\n0.371125 0.203719 0.615891 F\n0.084063 0.749421 0.880010 F\n0.658198 0.715061 0.971230 F\n0.246247 0.687316 0.530126 F\n0.345339 0.282012 0.028504 F\n0.757288 0.309726 0.469609 F\n0.919503 0.247658 0.119735 F\n0.632429 0.793330 0.383857 F\n",
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},
{
"id": "jvasp-98719",
"created_at": "2022-09-04T14:35:55.580560Z",
"updated_at": "2022-09-04T14:35:55.580589Z",
"structure_string": "As2 Cl2 F16\n1.0\n5.409322 -0.029708 1.568657\n-0.144306 5.407479 1.568657\n0.380280 0.388424 9.918421\nAs Cl F\n2 2 16\ndirect\n0.499999 0.499999 0.500000 As\n0.000000 0.000000 0.000000 As\n0.401458 0.098541 0.250000 Cl\n0.598541 0.901458 0.750001 Cl\n0.724558 0.394895 0.366954 F\n0.105104 0.775442 0.133047 F\n0.275441 0.605104 0.633047 F\n0.894895 0.224557 0.866954 F\n0.369596 0.684539 0.355288 F\n0.815460 0.130402 0.144713 F\n0.103333 0.081230 0.336043 F\n0.296679 0.244092 0.535686 F\n0.255908 0.203319 0.964315 F\n0.703319 0.755907 0.464315 F\n0.744091 0.796680 0.035686 F\n0.581230 0.603332 0.836043 F\n0.896666 0.918769 0.663958 F\n0.418769 0.396667 0.163958 F\n0.184539 0.869597 0.855288 F\n0.630402 0.315460 0.644713 F\n",
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{
"id": "jvasp-69866",
"created_at": "2022-09-04T14:36:12.033936Z",
"updated_at": "2022-09-04T14:36:12.033964Z",
"structure_string": "Sr1 Sc1 Be2\n1.0\n3.450143 -0.000000 -0.000000\n-0.000000 3.450143 -0.000000\n0.000000 0.000000 6.834534\nSr Sc Be\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Sr\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.829505 Be\n0.000000 0.000000 0.170495 Be\n",
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{
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"created_at": "2022-09-04T14:37:02.723692Z",
"updated_at": "2022-09-04T14:37:02.723736Z",
"structure_string": "K2 Tl1 In1 Cl6\n1.0\n6.714741 -0.000000 3.876757\n2.238247 6.330718 3.876757\n-0.000000 -0.000000 7.753515\nK Tl In Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 In\n0.769245 0.230755 0.230755 Cl\n0.230755 0.230755 0.769244 Cl\n0.230756 0.769245 0.769244 Cl\n0.230756 0.769245 0.230755 Cl\n0.769245 0.230755 0.769245 Cl\n0.769245 0.769245 0.230755 Cl\n",
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}
]
}