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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=1248",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_full&page=1246",
"results": [
{
"id": "jvasp-31822",
"created_at": "2022-09-04T14:37:04.274298Z",
"updated_at": "2022-09-04T14:37:04.274317Z",
"structure_string": "Sb2 Kr6 F22\n1.0\n7.136516 -0.068229 3.511253\n-0.338832 7.952100 2.999912\n-0.065096 0.014342 8.976062\nSb Kr F\n2 6 22\ndirect\n0.292329 0.678139 0.780504 Sb\n0.707671 0.321861 0.219495 Sb\n0.807686 0.854689 0.712179 Kr\n0.192314 0.145311 0.287820 Kr\n0.227146 0.164517 0.778034 Kr\n0.772855 0.835483 0.221966 Kr\n0.693602 0.330389 0.726750 Kr\n0.306398 0.669610 0.273249 Kr\n0.128549 0.555215 0.260792 F\n0.871452 0.444785 0.739207 F\n0.774789 0.444895 0.330666 F\n0.225211 0.555105 0.669334 F\n0.484266 0.799669 0.312017 F\n0.515734 0.200331 0.687982 F\n0.669043 0.530523 0.063622 F\n0.024065 0.893130 0.148662 F\n0.036673 0.681651 0.939788 F\n0.632586 0.198304 0.113601 F\n0.367414 0.801696 0.886399 F\n0.448735 0.317630 0.380838 F\n0.551265 0.682369 0.619161 F\n0.261661 0.887625 0.619065 F\n0.738339 0.112374 0.380934 F\n0.674294 0.927796 0.915059 F\n0.325706 0.072204 0.084940 F\n0.946465 0.790710 0.504324 F\n0.053535 0.209289 0.495675 F\n0.975935 0.106870 0.851337 F\n0.963327 0.318348 0.060212 F\n0.330957 0.469477 0.936377 F\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Sb",
"Kr",
"F"
],
"chemical_system": "F-Kr-Sb",
"density": 3.7856775266725387,
"density_atomic": 0.05874365930463531,
"volume": 510.69341534249264,
"volume_molar": 10.25155877465878,
"formula_full": "Sb2 Kr6 F22",
"formula_reduced": "SbKr3F11",
"formula_anonymous": "AB3C11",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-15889",
"created_at": "2022-09-04T14:37:55.516674Z",
"updated_at": "2022-09-04T14:37:55.516702Z",
"structure_string": "Sb2 Ir2\n1.0\n2.035282 -3.525212 0.000000\n2.035282 3.525212 0.000000\n0.000000 -0.000000 5.621321\nSb Ir\n2 2\ndirect\n0.666666 0.333333 0.250000 Sb\n0.333333 0.666666 0.750000 Sb\n0.000000 0.000000 0.500000 Ir\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sb",
"Ir"
],
"chemical_system": "Ir-Sb",
"density": 12.927028774059252,
"density_atomic": 0.04958859210251565,
"volume": 80.66371377777185,
"volume_molar": 12.144205964852334,
"formula_full": "Sb2 Ir2",
"formula_reduced": "SbIr",
"formula_anonymous": "AB",
"energy_above_hull": 1.9975136,
"spacegroup": 194
},
{
"id": "jvasp-176",
"created_at": "2022-09-04T14:37:28.293070Z",
"updated_at": "2022-09-04T14:37:28.293091Z",
"structure_string": "Sb2 I6\n1.0\n6.654466 0.023797 4.682924\n2.443504 6.189649 4.682926\n0.034843 0.023793 8.136982\nSb I\n2 6\ndirect\n0.167477 0.167477 0.167477 Sb\n0.832522 0.832523 0.832523 Sb\n0.416229 0.077210 0.747444 I\n0.747444 0.416229 0.077209 I\n0.077209 0.747444 0.416229 I\n0.583771 0.922791 0.252556 I\n0.252555 0.583771 0.922791 I\n0.922790 0.252556 0.583771 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sb",
"I"
],
"chemical_system": "I-Sb",
"density": 5.00820064850543,
"density_atomic": 0.024009301722091654,
"volume": 333.20419279995,
"volume_molar": 25.082531885793472,
"formula_full": "Sb2 I6",
"formula_reduced": "SbI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.07526123125,
"spacegroup": 148
},
{
"id": "jvasp-12913",
"created_at": "2022-09-04T14:36:57.416883Z",
"updated_at": "2022-09-04T14:36:57.416912Z",
"structure_string": "Sb2 I4 F12\n1.0\n5.731680 0.123885 0.131891\n1.169031 7.893459 0.076433\n1.408432 1.591540 7.985302\nSb I F\n2 4 12\ndirect\n0.435630 0.300163 0.321608 Sb\n0.564369 0.699837 0.678391 Sb\n0.116938 0.247203 0.935836 I\n0.883062 0.752796 0.064163 I\n0.877183 0.111123 0.769282 I\n0.122816 0.888877 0.230717 I\n0.445217 0.825615 0.478198 F\n0.554783 0.174385 0.521801 F\n0.417233 0.879762 0.801877 F\n0.582767 0.120238 0.198123 F\n0.691090 0.580551 0.881835 F\n0.717673 0.413641 0.244941 F\n0.282327 0.586359 0.755058 F\n0.272141 0.484013 0.430654 F\n0.844516 0.819265 0.613260 F\n0.155483 0.180734 0.386739 F\n0.308910 0.419448 0.118164 F\n0.727858 0.515987 0.569346 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Sb",
"I",
"F"
],
"chemical_system": "F-I-Sb",
"density": 4.538783521874178,
"density_atomic": 0.05024901162507802,
"volume": 358.2160010290959,
"volume_molar": 11.98459544823067,
"formula_full": "Sb2 I4 F12",
"formula_reduced": "Sb(IF3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-115109",
"created_at": "2022-09-04T14:38:42.864809Z",
"updated_at": "2022-09-04T14:38:42.864839Z",
"structure_string": "Sb2 I2 O2\n1.0\n3.923462 0.000000 0.000000\n-0.000000 3.923462 0.000000\n-0.000000 0.000000 9.068523\nSb I O\n2 2 2\ndirect\n0.499999 0.000000 0.868630 Sb\n0.000000 0.499999 0.131370 Sb\n0.000000 0.499999 0.666601 I\n0.499999 0.000000 0.333399 I\n0.499999 0.499999 0.000000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sb",
"I",
"O"
],
"chemical_system": "I-O-Sb",
"density": 6.296486717520057,
"density_atomic": 0.04298092820846296,
"volume": 139.5967990942224,
"volume_molar": 14.011192896514128,
"formula_full": "Sb2 I2 O2",
"formula_reduced": "SbIO",
"formula_anonymous": "ABC",
"energy_above_hull": 0.777695291666667,
"spacegroup": 129
},
{
"id": "jvasp-33801",
"created_at": "2022-09-04T14:38:08.160555Z",
"updated_at": "2022-09-04T14:38:08.160592Z",
"structure_string": "Sb2 H8 Pt1 O4 F12\n1.0\n4.971778 0.039307 -0.045413\n1.945748 7.615610 -0.041977\n0.925294 2.885888 7.991504\nSb H Pt O F\n2 8 1 4 12\ndirect\n0.352313 0.334544 0.337612 Sb\n0.647687 0.665457 0.662387 Sb\n0.746951 0.750841 0.007058 H\n0.837577 0.709969 0.192560 H\n0.239640 0.860968 0.295940 H\n0.947840 0.009588 0.299601 H\n0.052162 0.990412 0.700399 H\n0.760359 0.139034 0.704059 H\n0.162424 0.290032 0.807440 H\n0.253050 0.249159 0.992941 H\n0.000002 0.000000 0.000001 Pt\n0.242186 0.187769 0.909957 O\n0.888323 0.022346 0.770543 O\n0.757814 0.812232 0.090043 O\n0.111677 0.977654 0.229456 O\n0.368879 0.534096 0.768101 F\n0.218941 0.375850 0.119798 F\n0.631124 0.465906 0.231898 F\n0.596959 0.103863 0.329188 F\n0.104377 0.569117 0.334492 F\n0.518906 0.707907 0.443773 F\n0.069793 0.203813 0.440699 F\n0.930205 0.796186 0.559302 F\n0.481096 0.292093 0.556228 F\n0.895623 0.430885 0.665507 F\n0.403044 0.896136 0.670812 F\n0.781059 0.624151 0.880201 F\n",
"nsites": 27,
"nelements": 5,
"elements": [
"Sb",
"H",
"Pt",
"O",
"F"
],
"chemical_system": "F-H-O-Pt-Sb",
"density": 4.0528653056981225,
"density_atomic": 0.0892155405771816,
"volume": 302.6378568725022,
"volume_molar": 6.750102864410895,
"formula_full": "Sb2 H8 Pt1 O4 F12",
"formula_reduced": "Sb2H8Pt(OF3)4",
"formula_anonymous": "AB2C4D8E12",
"energy_above_hull": 1.5654163329629631,
"spacegroup": 2
},
{
"id": "jvasp-33781",
"created_at": "2022-09-04T14:36:53.490297Z",
"updated_at": "2022-09-04T14:36:53.490315Z",
"structure_string": "Sb2 H8 N2 Cl12\n1.0\n0.000000 6.239849 -0.000000\n-6.014454 3.119925 -0.119419\n-2.197555 -0.000000 11.723951\nSb H N Cl\n2 8 2 12\ndirect\n0.000000 0.500000 0.500000 Sb\n0.500001 0.500000 -0.000000 Sb\n0.029156 0.947261 0.820019 H\n0.877260 0.867166 0.733777 H\n0.023583 0.947260 0.320020 H\n0.255575 0.867166 0.233777 H\n0.744426 0.132834 0.766223 H\n0.976418 0.052740 0.679980 H\n0.122741 0.132834 0.266223 H\n-0.029156 0.052740 0.179979 H\n0.093709 0.000000 0.250000 N\n0.906291 0.000001 0.750000 N\n0.313194 0.155314 0.610113 Cl\n0.468508 0.844687 0.889887 Cl\n0.686807 0.844687 0.389887 Cl\n0.216143 0.705842 0.533468 Cl\n0.791025 0.593931 0.671405 Cl\n0.384955 0.406070 0.828595 Cl\n0.078016 0.705841 0.033468 Cl\n0.921984 0.294159 0.966532 Cl\n0.615045 0.593930 0.171405 Cl\n0.208975 0.406070 0.328595 Cl\n0.783858 0.294158 0.466532 Cl\n0.531493 0.155313 0.110113 Cl\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sb",
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N-Sb",
"density": 2.6509460622414696,
"density_atomic": 0.05434425503819978,
"volume": 441.6290182491207,
"volume_molar": 11.081467131653389,
"formula_full": "Sb2 H8 N2 Cl12",
"formula_reduced": "SbH4NCl6",
"formula_anonymous": "ABC4D6",
"energy_above_hull": 1.7404753129166668,
"spacegroup": 15
},
{
"id": "jvasp-95598",
"created_at": "2022-09-04T14:36:21.018998Z",
"updated_at": "2022-09-04T14:36:21.019025Z",
"structure_string": "Sb2 H6 C4 O8 F12\n1.0\n4.758001 4.481604 -4.263357\n-4.758001 4.481604 4.263357\n-0.034685 0.000000 8.502744\nSb H C O F\n2 6 4 8 12\ndirect\n0.142240 0.140330 0.503334 Sb\n0.859669 0.857760 0.003334 Sb\n0.430950 0.065554 0.971394 H\n0.934445 0.569050 0.471394 H\n0.620080 0.102821 0.478072 H\n0.897178 0.379919 0.978072 H\n0.383773 0.597888 0.313199 H\n0.402111 0.616226 0.813199 H\n0.522546 0.070753 0.232092 C\n0.929247 0.477453 0.732092 C\n0.488662 0.838043 0.357571 C\n0.161957 0.511337 0.857571 C\n0.236140 0.468327 0.042318 O\n0.531672 0.763859 0.542318 O\n0.250974 0.587184 0.736315 O\n0.412814 0.749025 0.236315 O\n0.818318 0.407457 0.824248 O\n0.592542 0.181682 0.324248 O\n0.840385 0.515725 0.538592 O\n0.484274 0.159615 0.038592 O\n0.043821 0.236784 0.601517 F\n0.763215 0.956179 0.101517 F\n0.244618 0.038941 0.413728 F\n0.961058 0.755381 0.913728 F\n0.332099 0.980829 0.797689 F\n0.019170 0.667900 0.297690 F\n0.946764 0.306044 0.215360 F\n0.693956 0.053235 0.715360 F\n0.938545 0.916547 0.518199 F\n0.083452 0.061454 0.018199 F\n0.349023 0.363298 0.489973 F\n0.636702 0.650976 0.989973 F\n",
"nsites": 32,
"nelements": 5,
"elements": [
"Sb",
"H",
"C",
"O",
"F"
],
"chemical_system": "C-F-H-O-Sb",
"density": 3.003968576630994,
"density_atomic": 0.08857133841630746,
"volume": 361.29069033135744,
"volume_molar": 6.799198101415642,
"formula_full": "Sb2 H6 C4 O8 F12",
"formula_reduced": "SbH3C2(O2F3)2",
"formula_anonymous": "AB2C3D4E6",
"energy_above_hull": 2.2513782371875,
"spacegroup": 9
},
{
"id": "jvasp-118481",
"created_at": "2022-09-04T14:38:33.985247Z",
"updated_at": "2022-09-04T14:38:33.985268Z",
"structure_string": "Sb2 H2 O2\n1.0\n1.903043 1.098722 6.558234\n-1.903043 1.098722 6.558234\n-0.000000 -2.197445 6.558234\nSb H O\n2 2 2\ndirect\n0.240575 0.240575 0.240575 Sb\n0.759425 0.759425 0.759425 Sb\n0.612140 0.612140 0.612140 H\n0.387860 0.387860 0.387860 H\n0.869444 0.869444 0.869444 O\n0.130556 0.130556 0.130556 O\n",
"nsites": 6,
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"elements": [
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"H",
"O"
],
"chemical_system": "H-O-Sb",
"density": 5.601336246724214,
"density_atomic": 0.07292501679470191,
"volume": 82.27629233039693,
"volume_molar": 8.257990227075977,
"formula_full": "Sb2 H2 O2",
"formula_reduced": "SbHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8173365333333336,
"spacegroup": 166
},
{
"id": "jvasp-118480",
"created_at": "2022-09-04T14:38:50.710765Z",
"updated_at": "2022-09-04T14:38:50.710792Z",
"structure_string": "Sb2 H2 O2\n1.0\n3.836806 0.000000 -0.000000\n-0.000000 3.836806 0.000000\n0.000000 -0.000000 5.424754\nSb H O\n2 2 2\ndirect\n0.500001 0.000000 0.270026 Sb\n0.000000 0.500001 0.729973 Sb\n0.000000 0.000000 0.000000 H\n0.500001 0.500001 0.000000 H\n0.000000 0.000000 0.500000 O\n0.500001 0.500001 0.500000 O\n",
"nsites": 6,
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"elements": [
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"O"
],
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"density": 5.770940900113373,
"density_atomic": 0.0751331367239594,
"volume": 79.85823914212602,
"volume_molar": 8.015292615993744,
"formula_full": "Sb2 H2 O2",
"formula_reduced": "SbHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8225132000000008,
"spacegroup": 129
},
{
"id": "jvasp-30626",
"created_at": "2022-09-04T14:37:18.741585Z",
"updated_at": "2022-09-04T14:37:18.741615Z",
"structure_string": "Sb2 F8\n1.0\n4.432894 -0.233559 -2.635593\n-0.771175 4.814053 -1.698002\n-0.669478 0.487595 6.067112\nSb F\n2 8\ndirect\n-0.001754 0.498972 -0.001308 Sb\n0.498228 -0.001286 -0.001144 Sb\n0.007305 0.266852 0.230044 F\n0.535450 0.277576 0.767442 F\n0.123662 0.592624 0.763860 F\n-0.017533 0.138699 0.754558 F\n0.326007 0.858623 0.233703 F\n0.460491 0.402500 0.229527 F\n0.881086 0.726710 0.242699 F\n0.671704 0.731362 0.768089 F\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Sb",
"F"
],
"chemical_system": "F-Sb",
"density": 5.284396912906449,
"density_atomic": 0.08046220142742591,
"volume": 124.28195876569012,
"volume_molar": 7.484434496155017,
"formula_full": "Sb2 F8",
"formula_reduced": "SbF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.0272740565,
"spacegroup": 5
},
{
"id": "jvasp-11523",
"created_at": "2022-09-04T14:37:10.784712Z",
"updated_at": "2022-09-04T14:37:10.784731Z",
"structure_string": "Sb2 F8\n1.0\n5.145550 0.021103 0.414796\n-0.048163 5.138855 0.495666\n-1.808000 -1.907846 4.370075\nSb F\n2 8\ndirect\n0.498983 0.000453 -0.001293 Sb\n-0.001278 0.500636 -0.001148 Sb\n0.267142 0.222444 0.230083 F\n0.277294 0.232264 0.767500 F\n0.592432 0.640487 0.763853 F\n0.138466 0.772390 0.754628 F\n0.858844 0.907448 0.233660 F\n0.402721 0.768697 0.229444 F\n0.726993 0.361346 0.242701 F\n0.731047 0.096655 0.768045 F\n",
"nsites": 10,
"nelements": 2,
"elements": [
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],
"chemical_system": "F-Sb",
"density": 5.283715003439204,
"density_atomic": 0.08045181841914455,
"volume": 124.29799843555023,
"volume_molar": 7.485400427651433,
"formula_full": "Sb2 F8",
"formula_reduced": "SbF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.0272420565000001,
"spacegroup": 5
}
]
}