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{
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"results": [
{
"id": "jvasp-47094",
"created_at": "2022-09-04T14:38:08.476010Z",
"updated_at": "2022-09-04T14:38:08.476033Z",
"structure_string": "Li8 Ni1 O4 F2\n1.0\n5.186941 -0.032537 -0.022480\n-1.759166 4.997155 0.051959\n-2.386640 -0.913549 5.066458\nLi Ni O F\n8 1 4 2\ndirect\n0.187155 0.444630 0.291042 Li\n0.071782 0.200607 0.625276 Li\n0.429292 0.862197 0.634518 Li\n0.588075 0.243215 -0.047340 Li\n0.411924 0.756785 0.047341 Li\n0.570708 0.137803 0.365483 Li\n0.928217 0.799394 0.374724 Li\n0.812845 0.555370 0.708959 Li\n0.000000 0.000000 0.000000 Ni\n0.845469 0.097305 0.229761 O\n0.208966 0.806328 0.251004 O\n0.791034 0.193672 0.748997 O\n0.154531 0.902695 0.770240 O\n0.421348 0.509443 0.710534 F\n0.578652 0.490558 0.289467 F\n",
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{
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"structure_string": "B1 Sb1 O3\n1.0\n3.521260 0.000000 -0.000000\n0.000000 3.521260 -0.000000\n0.000000 0.000000 3.521260\nB Sb O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 B\n0.000000 0.000000 0.000000 Sb\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n",
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{
"id": "jvasp-48217",
"created_at": "2022-09-04T14:38:05.812691Z",
"updated_at": "2022-09-04T14:38:05.812707Z",
"structure_string": "Li3 Fe2 O6\n1.0\n4.889665 -0.004816 0.002812\n-2.431027 4.242491 0.000433\n-0.844005 -1.452056 4.632800\nLi Fe O\n3 2 6\ndirect\n0.999382 0.495198 0.000558 Li\n0.650689 0.844373 0.001068 Li\n0.348545 0.146506 0.001071 Li\n0.832238 0.663256 0.500896 Fe\n0.167428 0.328063 0.500897 Fe\n0.791370 0.287192 0.270817 O\n0.208276 0.704098 0.731013 O\n0.422647 0.548054 0.274288 O\n0.947451 0.072864 0.727505 O\n0.577041 0.443273 0.727501 O\n0.052230 0.918461 0.274278 O\n",
"nsites": 11,
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"elements": [
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],
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"volume": 96.07330115485462,
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"formula_full": "Li3 Fe2 O6",
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"formula_anonymous": "A2B3C6",
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"spacegroup": 12
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{
"id": "jvasp-54758",
"created_at": "2022-09-04T14:37:27.659506Z",
"updated_at": "2022-09-04T14:37:27.659534Z",
"structure_string": "Te1 H6 O6\n1.0\n5.308369 -0.040243 0.111075\n-2.470238 4.939631 -0.125047\n-2.472600 -1.651010 4.319922\nTe H O\n1 6 6\ndirect\n0.012944 0.981009 0.026288 Te\n0.118747 0.421143 0.869119 H\n0.625539 0.167950 0.309500 H\n0.007944 0.737145 0.603675 H\n0.614669 0.540599 0.067189 H\n0.516813 0.927153 0.570383 H\n0.173538 0.419644 0.396902 H\n0.198970 0.288164 0.873678 O\n0.475605 0.149025 0.383933 O\n0.098263 0.746033 0.820494 O\n0.862741 0.704559 0.209926 O\n0.554037 0.784125 0.662816 O\n0.948736 0.237726 0.234024 O\n",
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{
"id": "jvasp-114971",
"created_at": "2022-09-04T14:38:43.544349Z",
"updated_at": "2022-09-04T14:38:43.544366Z",
"structure_string": "Ge1 C3\n1.0\n3.963559 0.159085 0.834844\n2.286128 -4.588940 -0.133596\n-1.673002 1.018420 -2.092962\nGe C\n1 3\ndirect\n0.610653 0.386803 0.519742 Ge\n0.110627 0.886823 0.019692 C\n0.610609 0.088921 0.721792 C\n0.110645 0.684688 0.317593 C\n",
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{
"id": "jvasp-31192",
"created_at": "2022-09-04T14:38:35.590644Z",
"updated_at": "2022-09-04T14:38:35.590678Z",
"structure_string": "Li2 Ti2 O4\n1.0\n5.750817 -0.000000 -0.000000\n5.750817 5.112227 0.093330\n2.875408 3.452142 2.441187\nLi Ti O\n2 2 4\ndirect\n0.750002 -0.000001 0.500001 Li\n0.500000 0.500000 0.500001 Li\n0.250004 -0.000001 0.500001 Ti\n-0.000003 0.500000 0.500001 Ti\n0.000440 0.999997 0.999128 O\n0.249561 0.500002 0.000873 O\n0.750438 0.499997 0.999128 O\n0.499563 0.000002 0.000873 O\n",
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"volume": 69.91678651546378,
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"formula_full": "Li2 Ti2 O4",
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"spacegroup": 141
},
{
"id": "jvasp-31334",
"created_at": "2022-09-04T14:38:03.339121Z",
"updated_at": "2022-09-04T14:38:03.339151Z",
"structure_string": "Mg1 H12 Se1 O9\n1.0\n5.872169 -0.059136 -0.801670\n-0.910597 5.801437 -0.801670\n-0.051096 -0.059136 5.926417\nMg H Se O\n1 12 1 9\ndirect\n-0.000090 -0.000090 -0.000090 Mg\n0.382201 0.189323 0.815585 H\n0.284024 0.085121 0.421290 H\n0.085121 0.421290 0.284025 H\n0.421289 0.284025 0.085121 H\n0.740809 0.136460 0.630260 H\n0.136460 0.630260 0.740810 H\n0.630260 0.740809 0.136461 H\n0.954376 0.027639 0.536271 H\n0.027639 0.536271 0.954377 H\n0.815584 0.382201 0.189323 H\n0.536271 0.954377 0.027640 H\n0.189323 0.815585 0.382201 H\n0.542009 0.542009 0.542010 Se\n0.964212 0.339528 0.146570 O\n0.339528 0.146569 0.964213 O\n0.874932 0.056211 0.671834 O\n0.056211 0.671834 0.874933 O\n0.671834 0.874933 0.056212 O\n0.501593 0.257185 0.587847 O\n0.257185 0.587847 0.501594 O\n0.587846 0.501594 0.257186 O\n0.146569 0.964212 0.339528 O\n",
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{
"id": "jvasp-119696",
"created_at": "2022-09-04T14:38:52.486098Z",
"updated_at": "2022-09-04T14:38:52.486122Z",
"structure_string": "Li2 Fe4 O6\n1.0\n2.882211 -0.000108 0.000212\n0.000166 4.991978 0.040643\n-0.000612 -0.142016 7.288945\nLi Fe O\n2 4 6\ndirect\n0.500003 0.499739 0.490927 Li\n-0.000019 0.000293 0.509076 Li\n0.000007 0.678432 0.177378 Fe\n0.499992 0.821562 0.822620 Fe\n0.500017 0.151123 0.176129 Fe\n-0.000011 0.348877 0.823869 Fe\n0.499999 0.526959 0.008031 O\n0.000001 0.973037 0.991967 O\n0.499984 0.149957 0.682105 O\n-0.000013 0.680660 0.673808 O\n0.500012 0.819341 0.326187 O\n0.000018 0.350039 0.317897 O\n",
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{
"id": "jvasp-103790",
"created_at": "2022-09-04T14:36:39.746741Z",
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"structure_string": "H16 C18 O2\n1.0\n4.434753 0.070803 -0.861560\n-0.443687 6.523251 -0.910659\n-0.128493 0.032788 10.885712\nH C O\n16 18 2\ndirect\n0.894418 0.251249 0.802505 H\n0.483257 0.937084 0.181114 H\n0.483258 0.437086 0.681114 H\n0.044398 0.256510 0.605540 H\n0.634581 0.437615 0.486248 H\n0.634581 0.937615 0.986249 H\n0.642952 0.919834 0.668436 H\n0.642952 0.419833 0.168436 H\n0.044396 0.756509 0.105541 H\n0.172431 0.406898 0.318532 H\n0.106655 0.693976 0.696109 H\n0.106655 0.193975 0.196109 H\n0.375974 0.103673 0.695619 H\n0.375973 0.603672 0.195619 H\n0.894417 0.751248 0.302506 H\n0.172432 0.906899 0.818533 H\n0.528148 0.697683 0.826755 C\n0.606310 0.004976 0.274966 C\n0.606311 0.504977 0.774966 C\n0.836451 0.902330 0.341165 C\n0.836452 0.402331 0.841165 C\n0.401040 0.942108 0.663464 C\n0.401040 0.442107 0.163464 C\n0.528148 0.197682 0.326755 C\n0.998946 0.989735 0.461533 C\n0.279496 0.807795 0.752972 C\n0.691087 0.286537 0.446288 C\n0.691087 0.786537 0.946288 C\n0.922549 0.183489 0.512920 C\n0.922548 0.683489 0.012920 C\n0.243925 0.872207 0.526977 C\n0.243925 0.372207 0.026977 C\n0.279496 0.307794 0.252972 C\n0.998946 0.489736 0.961533 C\n0.315756 0.209460 0.972271 O\n0.315754 0.709460 0.472271 O\n",
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{
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"created_at": "2022-09-04T14:38:44.010644Z",
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"structure_string": "Li2 V6 O8\n1.0\n5.044756 0.000367 -1.638542\n-0.000434 5.662574 -0.000123\n0.067067 0.000083 4.874298\nLi V O\n2 6 8\ndirect\n-0.007735 -0.000010 -0.001691 Li\n0.492271 0.499989 0.498311 Li\n-0.006823 0.500009 -0.044595 V\n0.493179 0.000009 0.455409 V\n0.507707 0.211120 0.026174 V\n0.507715 0.788875 0.026165 V\n0.007711 0.288876 0.526166 V\n0.007707 0.711117 0.526175 V\n0.733501 0.245061 0.740883 O\n0.233502 0.745059 0.240884 O\n0.233499 0.254944 0.240881 O\n0.733502 0.754943 0.740883 O\n0.240789 0.000002 0.735344 O\n0.740793 0.500002 0.235343 O\n0.291351 0.499997 0.776841 O\n0.791346 -0.000002 0.276838 O\n",
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{
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"structure_string": "Fe1 Co2 N2\n1.0\n2.806154 -0.000420 0.000155\n-1.402740 2.431178 -0.000133\n-0.000338 -0.000374 6.407115\nFe Co N\n1 2 2\ndirect\n0.000005 0.000034 0.500001 Fe\n0.666645 0.333212 0.160263 Co\n0.333352 0.666780 0.839736 Co\n0.666606 0.333298 0.689525 N\n0.333390 0.666685 0.310472 N\n",
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{
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"created_at": "2022-09-04T14:38:16.567304Z",
"updated_at": "2022-09-04T14:38:16.567339Z",
"structure_string": "Tb2 H6 O6\n1.0\n3.145953 -5.448951 -0.000000\n3.145953 5.448951 -0.000000\n0.000000 -0.000000 3.569608\nTb H O\n2 6 6\ndirect\n0.666667 0.333333 0.250000 Tb\n0.333333 0.666667 0.750000 Tb\n0.134639 0.273764 0.250000 H\n0.273764 0.139125 0.750000 H\n0.726235 0.860874 0.250000 H\n0.865361 0.726235 0.750000 H\n0.860874 0.134638 0.750000 H\n0.139125 0.865361 0.250000 H\n0.393226 0.083217 0.750000 O\n0.310008 0.393226 0.250000 O\n0.606773 0.916782 0.250000 O\n0.689991 0.606773 0.750000 O\n0.916782 0.310008 0.750000 O\n0.083217 0.689991 0.250000 O\n",
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}
]
}