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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4058",
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"results": [
{
"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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{
"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",
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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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],
"chemical_system": "Na-Pt-S",
"density": 5.036229180937215,
"density_atomic": 0.0496879474919517,
"volume": 201.25604909761606,
"volume_molar": 12.119922564673148,
"formula_full": "Na4 Pt2 S4",
"formula_reduced": "Na2PtS2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.8740838799999998,
"spacegroup": 36
},
{
"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,
"nelements": 3,
"elements": [
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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
},
{
"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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"P",
"W"
],
"chemical_system": "Na-P-W",
"density": 2.8675299285296645,
"density_atomic": 0.04262207373697032,
"volume": 516.1644676363373,
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"formula_full": "Na12 P8 W2",
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"formula_anonymous": "AB4C6",
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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",
"nsites": 6,
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"elements": [
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"Zn",
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],
"chemical_system": "Na-P-Zn",
"density": 3.4750498391754534,
"density_atomic": 0.05259310260668358,
"volume": 114.08340072406214,
"volume_molar": 11.450438292329805,
"formula_full": "Na2 Zn2 P2",
"formula_reduced": "NaZnP",
"formula_anonymous": "ABC",
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"spacegroup": 129
},
{
"id": "jvasp-38219",
"created_at": "2022-09-04T14:38:31.899722Z",
"updated_at": "2022-09-04T14:38:31.899753Z",
"structure_string": "Rb3 Na1\n1.0\n-3.643241 3.643241 5.278980\n3.643241 -3.643241 5.278980\n3.643241 3.643241 -5.278980\nRb Na\n3 1\ndirect\n0.749999 0.250000 0.500000 Rb\n0.250000 0.749999 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Na\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Na-Rb",
"density": 1.6553089840321653,
"density_atomic": 0.014271649850664802,
"volume": 280.2759345874557,
"volume_molar": 42.19652824315527,
"formula_full": "Rb3 Na1",
"formula_reduced": "Rb3Na",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0085449999999999,
"spacegroup": 225
},
{
"id": "jvasp-38224",
"created_at": "2022-09-04T14:37:55.054870Z",
"updated_at": "2022-09-04T14:37:55.054899Z",
"structure_string": "Rb3 Na1\n1.0\n0.000000 5.198696 5.198696\n5.198696 0.000000 5.198696\n5.198696 5.198696 0.000000\nRb Na\n3 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Rb\n0.250000 0.250000 0.250000 Rb\n0.750001 0.750001 0.750001 Na\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Na-Rb",
"density": 1.6510172811914994,
"density_atomic": 0.014234647888616671,
"volume": 281.0044920885445,
"volume_molar": 42.30621513873804,
"formula_full": "Rb3 Na1",
"formula_reduced": "Rb3Na",
"formula_anonymous": "AB3",
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"spacegroup": 225
},
{
"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",
"nsites": 4,
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"elements": [
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"density": 1.3529457583171647,
"density_atomic": 0.021102777471040612,
"volume": 189.54850874436832,
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"formula_full": "Rb1 Na3",
"formula_reduced": "RbNa3",
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"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107216",
"created_at": "2022-09-04T14:36:59.873840Z",
"updated_at": "2022-09-04T14:36:59.873865Z",
"structure_string": "Rb6 Na2\n1.0\n9.308079 0.000000 0.000000\n-4.654040 8.061032 0.000000\n0.000000 -0.000000 7.403040\nRb Na\n6 2\ndirect\n0.827427 0.172573 0.750000 Rb\n0.345147 0.172573 0.750000 Rb\n0.827427 0.654853 0.750000 Rb\n0.172573 0.827426 0.250000 Rb\n0.654853 0.827426 0.250000 Rb\n0.172573 0.345146 0.250000 Rb\n0.666667 0.333333 0.250000 Na\n0.333333 0.666666 0.750000 Na\n",
"nsites": 8,
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"density_atomic": 0.014402211529817622,
"volume": 555.4702472906469,
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"formula_full": "Rb6 Na2",
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"energy_above_hull": 0.0,
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},
{
"id": "jvasp-38221",
"created_at": "2022-09-04T14:37:40.823610Z",
"updated_at": "2022-09-04T14:37:40.823619Z",
"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",
"nsites": 4,
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"formula_full": "Rb3 Na1",
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},
{
"id": "jvasp-2868",
"created_at": "2022-09-04T14:37:03.842549Z",
"updated_at": "2022-09-04T14:37:03.842566Z",
"structure_string": "Rb2 Na2 S2\n1.0\n4.676524 0.000000 0.000000\n0.000000 4.676524 0.000000\n0.000000 0.000000 7.562735\nRb Na S\n2 2 2\ndirect\n0.000000 0.500000 0.351720 Rb\n0.500000 0.000000 0.648279 Rb\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.000000 Na\n0.500000 0.000000 0.207056 S\n0.000000 0.500000 0.792944 S\n",
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"formula_full": "Rb2 Na2 S2",
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"spacegroup": 129
}
]
}