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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=588",
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"results": [
{
"id": "jvasp-79030",
"created_at": "2022-09-04T14:37:11.518030Z",
"updated_at": "2022-09-04T14:37:11.518049Z",
"structure_string": "Rb1 Na3\n1.0\n-3.212462 3.212462 4.591815\n3.212462 -3.212462 4.591815\n3.212462 3.212462 -4.591815\nRb Na\n1 3\ndirect\n0.000000 0.000000 0.000000 Rb\n0.750000 0.250000 0.500001 Na\n0.250000 0.750000 0.500001 Na\n0.499999 0.499999 0.000000 Na\n",
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{
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"created_at": "2022-09-04T14:37:40.823610Z",
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"structure_string": "Rb3 Na1\n1.0\n6.581444 -0.000000 -0.000000\n-0.000000 6.581444 -0.000000\n-0.000000 -0.000000 6.581444\nRb Na\n3 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.000000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Na\n",
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{
"id": "jvasp-2385",
"created_at": "2022-09-04T14:36:51.827098Z",
"updated_at": "2022-09-04T14:36:51.827122Z",
"structure_string": "Na2 Zn2 P2\n1.0\n4.068739 0.000000 0.000000\n0.000000 4.068739 0.000000\n0.000000 0.000000 6.891326\nNa Zn P\n2 2 2\ndirect\n0.000000 0.500000 0.644188 Na\n0.500000 0.000000 0.355812 Na\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.784586 P\n0.000000 0.500000 0.215415 P\n",
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],
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"formula_full": "Na2 Zn2 P2",
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"formula_anonymous": "ABC",
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"spacegroup": 129
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{
"id": "jvasp-45356",
"created_at": "2022-09-04T14:37:05.912907Z",
"updated_at": "2022-09-04T14:37:05.912928Z",
"structure_string": "Na12 P8 W2\n1.0\n4.567542 -7.911215 0.000000\n4.567542 7.911215 0.000000\n-0.000000 -0.000000 7.142206\nNa P W\n12 8 2\ndirect\n0.706367 0.853184 0.714141 Na\n0.853184 0.706367 0.214141 Na\n0.146816 0.293632 0.714141 Na\n0.146816 0.853184 0.714141 Na\n0.467690 0.532310 0.392481 Na\n0.532310 0.064620 0.892482 Na\n0.293632 0.146816 0.214141 Na\n0.064620 0.532310 0.392481 Na\n0.467690 0.935379 0.392481 Na\n0.532310 0.467690 0.892482 Na\n0.853184 0.146816 0.214141 Na\n0.935379 0.467690 0.892482 Na\n0.387402 0.193701 0.607079 P\n0.806299 0.612598 0.607079 P\n0.333333 0.666667 0.679767 P\n0.666667 0.333333 0.179767 P\n0.806299 0.193701 0.607079 P\n0.193701 0.806299 0.107078 P\n0.612598 0.806299 0.107078 P\n0.193701 0.387402 0.107078 P\n0.666667 0.333333 0.504234 W\n0.333333 0.666667 0.004234 W\n",
"nsites": 22,
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"elements": [
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"chemical_system": "Na-P-W",
"density": 2.8675299285296645,
"density_atomic": 0.04262207373697032,
"volume": 516.1644676363373,
"volume_molar": 14.129159451893127,
"formula_full": "Na12 P8 W2",
"formula_reduced": "Na6P4W",
"formula_anonymous": "AB4C6",
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"spacegroup": 186
},
{
"id": "jvasp-11200",
"created_at": "2022-09-04T14:37:09.275521Z",
"updated_at": "2022-09-04T14:37:09.275541Z",
"structure_string": "Na4 Pt2 Se4\n1.0\n3.737554 0.000000 0.000000\n-1.868777 5.365286 0.000000\n0.000000 0.000000 11.293748\nNa Pt Se\n4 2 4\ndirect\n0.438337 0.876674 0.868214 Na\n0.561662 0.123326 0.368214 Na\n0.827091 0.654186 0.598104 Na\n0.172907 0.345815 0.098104 Na\n0.138069 0.276138 0.751936 Pt\n0.861930 0.723863 0.251936 Pt\n0.552153 0.104307 0.628660 Se\n0.447846 0.895694 0.128660 Se\n0.723585 0.447173 0.875385 Se\n0.276414 0.552828 0.375385 Se\n",
"nsites": 10,
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"elements": [
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"Pt",
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],
"chemical_system": "Na-Pt-Se",
"density": 5.8508050095095046,
"density_atomic": 0.04415516924071919,
"volume": 226.47404985548465,
"volume_molar": 13.638586067169863,
"formula_full": "Na4 Pt2 Se4",
"formula_reduced": "Na2PtSe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6794632266666666,
"spacegroup": 36
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{
"id": "jvasp-10663",
"created_at": "2022-09-04T14:37:11.561562Z",
"updated_at": "2022-09-04T14:37:11.561578Z",
"structure_string": "Na4 Pt2 S4\n1.0\n3.585318 -0.000000 0.000000\n-1.792658 5.184248 -0.000000\n-0.000000 0.000000 10.827682\nNa Pt S\n4 2 4\ndirect\n0.170747 0.341492 0.093181 Na\n0.829254 0.658508 0.593181 Na\n0.432470 0.864941 0.876409 Na\n0.567530 0.135059 0.376409 Na\n0.863897 0.727793 0.254593 Pt\n0.136104 0.272207 0.754593 Pt\n0.551251 0.102502 0.635157 S\n0.448749 0.897499 0.135157 S\n0.720543 0.441085 0.874658 S\n0.279458 0.558915 0.374658 S\n",
"nsites": 10,
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"elements": [
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"density": 5.036229180937215,
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"volume": 201.25604909761606,
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"formula_full": "Na4 Pt2 S4",
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"formula_anonymous": "AB2C2",
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"spacegroup": 36
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{
"id": "jvasp-37754",
"created_at": "2022-09-04T14:38:00.047761Z",
"updated_at": "2022-09-04T14:38:00.047793Z",
"structure_string": "Na3 Pt1\n1.0\n-2.471603 2.471603 3.519797\n2.471603 -2.471603 3.519797\n2.471603 2.471603 -3.519797\nNa Pt\n3 1\ndirect\n0.750001 0.250000 0.500000 Na\n0.250000 0.750001 0.500000 Na\n0.500001 0.500001 0.000000 Na\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
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"elements": [
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"volume": 86.00724480272636,
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"formula_full": "Na3 Pt1",
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"spacegroup": 225
},
{
"id": "jvasp-37799",
"created_at": "2022-09-04T14:38:15.691131Z",
"updated_at": "2022-09-04T14:38:15.691147Z",
"structure_string": "Na6 Pt2\n1.0\n3.182457 -5.512176 -0.000000\n3.182457 5.512176 0.000000\n0.000000 -0.000000 5.084004\nNa Pt\n6 2\ndirect\n0.820490 0.179511 0.250000 Na\n0.820490 0.640978 0.250000 Na\n0.359023 0.179511 0.250000 Na\n0.179511 0.820490 0.749999 Na\n0.179511 0.359023 0.749999 Na\n0.640978 0.820490 0.749999 Na\n0.666668 0.333333 0.749999 Pt\n0.333333 0.666668 0.250000 Pt\n",
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"volume": 178.36987150262533,
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"formula_full": "Na6 Pt2",
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"spacegroup": 194
},
{
"id": "jvasp-20648",
"created_at": "2022-09-04T14:38:12.549452Z",
"updated_at": "2022-09-04T14:38:12.549480Z",
"structure_string": "Na2 Pt4\n1.0\n4.635353 0.000000 2.676222\n1.545118 4.370253 2.676222\n-0.000000 0.000000 5.352445\nNa Pt\n2 4\ndirect\n0.875000 0.874999 0.874999 Na\n0.125000 0.125000 0.125000 Na\n0.500000 0.500000 0.499999 Pt\n0.500000 0.500000 -0.000000 Pt\n0.000000 0.500000 0.499999 Pt\n0.500000 0.000000 0.500000 Pt\n",
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},
{
"id": "jvasp-4714",
"created_at": "2022-09-04T14:37:55.297458Z",
"updated_at": "2022-09-04T14:37:55.297485Z",
"structure_string": "Na2 Yb2 P4 S12\n1.0\n7.185695 -0.050108 -0.089868\n0.204145 7.222423 -0.036813\n2.343764 0.312327 9.139042\nYb Na P S\n2 2 4 12\ndirect\n0.956200 0.118553 0.725824 Yb\n0.043801 0.881447 0.274175 Yb\n0.517013 0.382111 0.313468 Na\n0.482988 0.617889 0.686532 Na\n0.719908 0.021371 0.072139 P\n0.280093 0.978629 0.927861 P\n0.055742 0.608079 0.562350 P\n0.944259 0.391921 0.437650 P\n0.697622 0.297266 0.574775 S\n0.302378 0.702733 0.425225 S\n0.856490 0.817285 0.957271 S\n0.153366 0.189648 0.420838 S\n0.092438 0.486199 0.750471 S\n0.656021 0.248150 0.971938 S\n0.344305 0.995702 0.713495 S\n0.907563 0.513800 0.249529 S\n0.143511 0.182715 0.042729 S\n0.655696 0.004298 0.286505 S\n0.846635 0.810352 0.579162 S\n0.343980 0.751850 0.028062 S\n",
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"formula_full": "Na2 Yb2 P4 S12",
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{
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"created_at": "2022-09-04T14:38:33.533495Z",
"updated_at": "2022-09-04T14:38:33.533510Z",
"structure_string": "Na2 Sb2 P4 S12\n1.0\n0.000000 6.538192 -0.059149\n7.477270 0.000000 0.000000\n0.000000 -0.472030 -9.339188\nNa Sb P S\n2 2 4 12\ndirect\n0.305801 0.548456 0.499060 Na\n0.694199 0.048456 0.500940 Na\n0.189524 0.264027 0.016266 Sb\n0.810475 0.764027 0.983734 Sb\n0.313704 0.830153 0.184883 P\n0.185476 0.048288 0.321626 P\n0.814524 0.548288 0.678374 P\n0.686296 0.330153 0.815118 P\n0.424526 0.239805 0.721680 S\n0.910853 0.134712 0.822072 S\n0.575474 0.739805 0.278320 S\n0.089147 0.634712 0.177929 S\n0.066363 0.628144 0.806756 S\n0.933637 0.128144 0.193245 S\n0.875214 0.441298 0.491824 S\n0.124786 0.941298 0.508176 S\n0.648575 0.447644 0.015239 S\n0.351425 0.947644 0.984761 S\n0.399620 0.244175 0.305444 S\n0.600379 0.744175 0.694557 S\n",
"nsites": 20,
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],
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"volume": 456.781372436302,
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"formula_full": "Na2 Sb2 P4 S12",
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{
"id": "jvasp-3225",
"created_at": "2022-09-04T14:36:18.588727Z",
"updated_at": "2022-09-04T14:36:18.588753Z",
"structure_string": "Na3 Sr3 P3\n1.0\n3.829202 -6.632373 0.000000\n3.829202 6.632373 0.000000\n0.000000 0.000000 4.483194\nNa Sr P\n3 3 3\ndirect\n-0.000000 0.757799 0.000000 Na\n0.757799 -0.000000 0.000000 Na\n0.242200 0.242200 0.000000 Na\n0.585415 0.585415 0.500000 Sr\n-0.000000 0.414584 0.500000 Sr\n0.414584 -0.000000 0.500000 Sr\n0.333333 0.666667 0.000000 P\n0.000000 0.000000 0.500000 P\n0.666667 0.333333 0.000000 P\n",
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"formula_full": "Na3 Sr3 P3",
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}
]
}