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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3415",
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"results": [
{
"id": "jvasp-29908",
"created_at": "2022-09-04T14:36:49.299623Z",
"updated_at": "2022-09-04T14:36:49.299646Z",
"structure_string": "Zr1 P2 H2 O6\n1.0\n5.461459 -0.000009 -0.000029\n-2.730737 4.729764 0.000084\n-0.000018 0.000066 5.390100\nZr P H O\n1 2 2 6\ndirect\n0.000000 0.000000 0.000000 Zr\n0.666669 0.333347 0.695685 P\n0.333330 0.666652 0.304314 P\n0.666664 0.333353 0.435592 H\n0.333336 0.666647 0.564407 H\n0.359966 0.141533 0.779696 O\n0.781572 0.640053 0.779682 O\n0.858479 0.218448 0.779678 O\n0.640033 0.858467 0.220303 O\n0.218427 0.359947 0.220317 O\n0.141521 0.781552 0.220321 O\n",
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{
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"structure_string": "Rb3 Ho1\n1.0\n0.000000 5.005178 5.005178\n5.005178 0.000000 5.005178\n5.005178 5.005178 0.000000\nRb Ho\n3 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Rb\n0.250001 0.250001 0.250001 Rb\n0.750000 0.750000 0.750000 Ho\n",
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{
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"created_at": "2022-09-04T14:38:08.231500Z",
"updated_at": "2022-09-04T14:38:08.231518Z",
"structure_string": "Rb4 H4 O4\n1.0\n4.005124 -0.000000 0.000000\n-0.000000 6.484173 0.000000\n0.000000 0.000000 7.930076\nRb H O\n4 4 4\ndirect\n0.250000 0.992186 0.808226 Rb\n0.749999 0.507813 0.308225 Rb\n0.250000 0.492186 0.691775 Rb\n0.749999 0.007814 0.191775 Rb\n0.749999 0.066208 0.544403 H\n0.250000 0.433792 0.044402 H\n0.749999 0.566208 0.955598 H\n0.250000 0.933792 0.455598 H\n0.250000 0.790567 0.417556 O\n0.749999 0.709432 0.917556 O\n0.250000 0.290568 0.082445 O\n0.749999 0.209432 0.582445 O\n",
"nsites": 12,
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"elements": [
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"chemical_system": "H-O-Rb",
"density": 3.3050626752356065,
"density_atomic": 0.058268432688462476,
"volume": 205.94341475012897,
"volume_molar": 10.335168601836141,
"formula_full": "Rb4 H4 O4",
"formula_reduced": "RbHO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7468778333333337,
"spacegroup": 62
},
{
"id": "jvasp-51721",
"created_at": "2022-09-04T14:38:10.247584Z",
"updated_at": "2022-09-04T14:38:10.247615Z",
"structure_string": "Rb2 H2 O2\n1.0\n0.000000 4.164277 -0.035168\n4.167365 0.000000 0.000000\n0.000000 -1.521652 -5.793460\nRb H O\n2 2 2\ndirect\n0.826945 0.749999 0.710749 Rb\n0.173056 0.250000 0.289251 Rb\n0.521764 0.749999 0.078572 H\n0.478238 0.250000 0.921428 H\n0.673507 0.749999 0.231308 O\n0.326495 0.250000 0.768692 O\n",
"nsites": 6,
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"density_atomic": 0.059545621995075466,
"volume": 100.76307541965404,
"volume_molar": 10.113490393127545,
"formula_full": "Rb2 H2 O2",
"formula_reduced": "RbHO",
"formula_anonymous": "ABC",
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"spacegroup": 11
},
{
"id": "jvasp-51007",
"created_at": "2022-09-04T14:37:13.950989Z",
"updated_at": "2022-09-04T14:37:13.950997Z",
"structure_string": "Rb2 H2 O2\n1.0\n2.069959 0.000000 5.426715\n0.000000 4.186996 0.000000\n-2.069959 0.000000 5.426715\nRb H O\n2 2 2\ndirect\n0.360587 0.260293 0.360587 Rb\n0.639412 0.760294 0.639412 Rb\n0.032431 0.398042 0.032431 H\n0.967568 0.898042 0.967568 H\n0.098988 0.237058 0.098988 O\n0.901011 0.737058 0.901011 O\n",
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"volume": 94.06570157831173,
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"formula_full": "Rb2 H2 O2",
"formula_reduced": "RbHO",
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"spacegroup": 36
},
{
"id": "jvasp-12890",
"created_at": "2022-09-04T14:38:33.334364Z",
"updated_at": "2022-09-04T14:38:33.334391Z",
"structure_string": "Rb2 H6 O4\n1.0\n4.224777 0.000000 0.000000\n-2.112388 5.518776 0.000000\n0.000000 0.000000 5.929076\nRb H O\n2 6 4\ndirect\n0.845547 0.691093 0.268017 Rb\n0.154453 0.308908 0.768017 Rb\n0.489788 0.979575 0.020172 H\n0.510213 0.020426 0.520172 H\n0.303756 0.217272 0.298846 H\n0.696245 0.782729 0.798846 H\n0.086484 0.782729 0.798846 H\n0.913517 0.217272 0.298846 H\n0.839442 0.678883 0.758955 O\n0.468251 0.936502 0.859267 O\n0.160559 0.321118 0.258954 O\n0.531749 0.063499 0.359266 O\n",
"nsites": 12,
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"elements": [
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],
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"density": 2.8946631802163565,
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"volume": 138.23995201133377,
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"formula_full": "Rb2 H6 O4",
"formula_reduced": "RbH3O2",
"formula_anonymous": "AB2C3",
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"spacegroup": 36
},
{
"id": "jvasp-118469",
"created_at": "2022-09-04T14:38:33.790400Z",
"updated_at": "2022-09-04T14:38:33.790430Z",
"structure_string": "Rb2 H2 O2\n1.0\n4.130908 0.000000 -0.002421\n0.000000 4.176241 0.000000\n-2.060824 0.000000 5.422229\nRb H O\n2 2 2\ndirect\n0.139510 0.761540 0.278805 Rb\n0.860491 0.261539 0.721195 Rb\n0.467020 0.898045 0.934128 H\n0.532982 0.398045 0.065871 H\n0.399763 0.738453 0.800099 O\n0.600239 0.238453 0.199901 O\n",
"nsites": 6,
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"elements": [
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"density_atomic": 0.06415626432859158,
"volume": 93.5216547096566,
"volume_molar": 9.386676146161149,
"formula_full": "Rb2 H2 O2",
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"formula_anonymous": "ABC",
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},
{
"id": "jvasp-118467",
"created_at": "2022-09-04T14:38:49.847838Z",
"updated_at": "2022-09-04T14:38:49.847859Z",
"structure_string": "Rb2 H2 O2\n1.0\n4.144136 0.000000 -0.031674\n0.000000 4.172710 0.000000\n-1.408270 0.000000 5.800585\nRb H O\n2 2 2\ndirect\n0.826181 0.750000 0.211569 Rb\n0.173821 0.250000 0.788433 Rb\n0.521045 0.750000 0.579850 H\n0.478957 0.250000 0.420152 H\n0.675805 0.750000 0.731610 O\n0.324197 0.250000 0.268392 O\n",
"nsites": 6,
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"volume": 100.11920080869841,
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"formula_full": "Rb2 H2 O2",
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"formula_anonymous": "ABC",
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"spacegroup": 11
},
{
"id": "jvasp-118465",
"created_at": "2022-09-04T14:38:33.774286Z",
"updated_at": "2022-09-04T14:38:33.774319Z",
"structure_string": "Rb1 H1 O1\n1.0\n4.508040 -0.000000 -0.000000\n-2.254020 3.904077 0.000000\n0.000000 0.000000 3.619592\nRb H O\n1 1 1\ndirect\n0.666666 0.333334 0.000000 Rb\n0.000000 0.000000 0.000000 H\n0.333333 0.666668 0.000000 O\n",
"nsites": 3,
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"elements": [
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"formula_full": "Rb1 H1 O1",
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"spacegroup": 187
},
{
"id": "jvasp-51017",
"created_at": "2022-09-04T14:37:28.095195Z",
"updated_at": "2022-09-04T14:37:28.095230Z",
"structure_string": "Rb2 H2 O2\n1.0\n0.000000 4.137279 0.152423\n4.187887 0.000000 0.000000\n0.000000 -1.861053 -5.498286\nRb H O\n2 2 2\ndirect\n0.139508 0.761254 0.278808 Rb\n0.860493 0.261254 0.721193 Rb\n0.467491 0.898880 0.935076 H\n0.532511 0.398880 0.064925 H\n0.400485 0.737904 0.801976 O\n0.599517 0.237904 0.198026 O\n",
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},
{
"id": "jvasp-118464",
"created_at": "2022-09-04T14:38:52.942679Z",
"updated_at": "2022-09-04T14:38:52.942703Z",
"structure_string": "Rb1 H1 O1\n1.0\n3.849218 -1.704284 0.000000\n-1.608409 5.292010 0.000000\n0.000000 0.000000 4.468978\nRb H O\n1 1 1\ndirect\n0.018402 0.421683 0.000000 Rb\n-0.097619 -0.135134 0.000000 H\n0.207047 0.015293 0.000000 O\n",
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},
{
"id": "jvasp-1666",
"created_at": "2022-09-04T14:36:56.526001Z",
"updated_at": "2022-09-04T14:36:56.526026Z",
"structure_string": "Rb1 Ho1 S2\n1.0\n3.904760 0.001694 6.945132\n1.819831 3.454761 6.945132\n0.002806 0.001694 7.967560\nRb Ho S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.499999 0.500000 Ho\n0.768915 0.768912 0.768914 S\n0.231087 0.231086 0.231086 S\n",
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}
]
}