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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=233",
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"results": [
{
"id": "jvasp-111787",
"created_at": "2022-09-04T14:38:53.034869Z",
"updated_at": "2022-09-04T14:38:53.034903Z",
"structure_string": "Rb2 Sb2 W2 O12\n1.0\n6.395292 -0.026651 -3.573809\n-2.148307 5.919981 -3.743152\n0.068839 0.026651 7.325785\nRb Sb W O\n2 2 2 12\ndirect\n0.659510 0.382327 0.777182 Rb\n0.394855 0.617673 0.277182 Rb\n-0.003731 0.500000 0.496269 Sb\n-0.003731 -0.000000 -0.003731 Sb\n0.515497 0.991197 0.024302 W\n0.033105 0.008803 0.524302 W\n0.316656 0.688792 0.752840 O\n0.934674 0.066754 0.743406 O\n0.317505 0.063209 0.754296 O\n0.916100 0.672183 0.743917 O\n0.064048 0.311207 0.627863 O\n0.064048 0.936184 0.252841 O\n0.676653 0.308733 0.243406 O\n0.316656 0.063816 0.127863 O\n0.691089 0.936791 0.254297 O\n0.071735 0.327817 0.243917 O\n0.676652 0.933246 0.867921 O\n0.934674 0.691267 0.367921 O\n",
"nsites": 18,
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"elements": [
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],
"chemical_system": "O-Rb-Sb-W",
"density": 5.7927734335612335,
"density_atomic": 0.0644605111970347,
"volume": 279.2407268533736,
"volume_molar": 9.342372016865154,
"formula_full": "Rb2 Sb2 W2 O12",
"formula_reduced": "RbSbWO6",
"formula_anonymous": "ABCD6",
"energy_above_hull": 2.8015374555555552,
"spacegroup": 46
},
{
"id": "jvasp-26635",
"created_at": "2022-09-04T14:37:41.892089Z",
"updated_at": "2022-09-04T14:37:41.892105Z",
"structure_string": "Rb2 Sb2 Br2 F6\n1.0\n4.415251 -0.009793 -0.056299\n-1.799316 7.415549 -0.012300\n-1.485996 -3.543253 8.092635\nRb Sb Br F\n2 2 2 6\ndirect\n0.983132 0.305839 0.648997 Rb\n0.016866 0.694162 0.351003 Rb\n0.305997 0.159447 0.207918 Sb\n0.694002 0.840554 0.792083 Sb\n0.429995 0.761360 0.064769 Br\n0.570003 0.238641 0.935232 Br\n0.597600 0.549680 0.677720 F\n0.695665 0.885740 0.583031 F\n0.304333 0.114261 0.416970 F\n0.402398 0.450321 0.322280 F\n0.211087 0.762997 0.698131 F\n0.788912 0.237004 0.301869 F\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Br",
"F"
],
"chemical_system": "Br-F-Rb-Sb",
"density": 4.334800700713292,
"density_atomic": 0.04551478832005636,
"volume": 263.65057254835415,
"volume_molar": 13.23117382783984,
"formula_full": "Rb2 Sb2 Br2 F6",
"formula_reduced": "RbSbBrF3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-98249",
"created_at": "2022-09-04T14:36:18.357719Z",
"updated_at": "2022-09-04T14:36:18.357733Z",
"structure_string": "Rb8 Sb4 Au4 S16\n1.0\n6.727327 -0.000000 0.000000\n0.000000 7.203863 0.000000\n0.000000 0.000000 20.203469\nRb Sb Au S\n8 4 4 16\ndirect\n0.299449 0.750000 0.011911 Rb\n0.909498 0.250000 0.670910 Rb\n0.700552 0.250000 0.988089 Rb\n0.299449 0.250000 0.488089 Rb\n0.090502 0.750000 0.329090 Rb\n0.090502 0.250000 0.170910 Rb\n0.700552 0.750000 0.511911 Rb\n0.909498 0.750000 0.829090 Rb\n0.793568 0.750000 0.109549 Sb\n0.793568 0.250000 0.390451 Sb\n0.206432 0.250000 0.890451 Sb\n0.206432 0.750000 0.609549 Sb\n0.597138 0.500000 0.250000 Au\n0.402862 0.500000 0.750000 Au\n0.597138 0.000000 0.250000 Au\n0.402862 0.000000 0.750000 Au\n0.801652 0.750000 0.993108 S\n0.897187 0.750000 0.662413 S\n0.399123 0.523862 0.864325 S\n0.600877 0.023862 0.135675 S\n0.399123 0.476138 0.635675 S\n0.198348 0.750000 0.493108 S\n0.897187 0.250000 0.837587 S\n0.198348 0.250000 0.006892 S\n0.600877 0.976137 0.364325 S\n0.102814 0.250000 0.337587 S\n0.399123 0.023862 0.635675 S\n0.801652 0.250000 0.506892 S\n0.600877 0.523862 0.364325 S\n0.102814 0.750000 0.162413 S\n0.600877 0.476138 0.135675 S\n0.399123 0.976137 0.864325 S\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Au",
"S"
],
"chemical_system": "Au-Rb-S-Sb",
"density": 4.191880914806384,
"density_atomic": 0.03268255866941771,
"volume": 979.1155069490809,
"volume_molar": 18.426160634831636,
"formula_full": "Rb8 Sb4 Au4 S16",
"formula_reduced": "Rb2SbAuS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.03596545875,
"spacegroup": 57
},
{
"id": "jvasp-110700",
"created_at": "2022-09-04T14:38:36.645636Z",
"updated_at": "2022-09-04T14:38:36.645656Z",
"structure_string": "Rb2 Sb1 Au1 I6\n1.0\n7.290098 -0.000000 4.208940\n2.430033 6.873170 4.208940\n-0.000000 -0.000000 8.417880\nRb Sb Au I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.746155 0.253845 0.253845 I\n0.253845 0.253845 0.746155 I\n0.253845 0.746155 0.746155 I\n0.253845 0.746155 0.253845 I\n0.746155 0.253845 0.746155 I\n0.746155 0.746155 0.253845 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Au",
"I"
],
"chemical_system": "Au-I-Rb-Sb",
"density": 4.925429605748747,
"density_atomic": 0.02370864955277828,
"volume": 421.78699287527144,
"volume_molar": 25.40060641832002,
"formula_full": "Rb2 Sb1 Au1 I6",
"formula_reduced": "Rb2SbAuI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-106441",
"created_at": "2022-09-04T14:36:56.418072Z",
"updated_at": "2022-09-04T14:36:56.418097Z",
"structure_string": "Rb2 Sb1 Au1 F6\n1.0\n5.666889 -0.000000 3.271780\n1.888963 5.342794 3.271780\n-0.000000 -0.000000 6.543559\nRb Sb Au F\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.764730 0.235270 0.235270 F\n0.235270 0.235270 0.764730 F\n0.235270 0.764730 0.764731 F\n0.235270 0.764730 0.235270 F\n0.764730 0.235270 0.764730 F\n0.764730 0.764730 0.235270 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Au",
"F"
],
"chemical_system": "Au-F-Rb-Sb",
"density": 5.059516380932318,
"density_atomic": 0.05047459487398861,
"volume": 198.11947029917349,
"volume_molar": 11.93103337438262,
"formula_full": "Rb2 Sb1 Au1 F6",
"formula_reduced": "Rb2SbAuF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-99715",
"created_at": "2022-09-04T14:36:20.758556Z",
"updated_at": "2022-09-04T14:36:20.758592Z",
"structure_string": "Rb2 Sb1 Au1 Cl6\n1.0\n6.504546 -0.000000 3.755401\n2.168182 6.132545 3.755401\n0.000000 0.000000 7.510802\nRb Sb Au Cl\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.750145 0.249855 0.249855 Cl\n0.249855 0.249855 0.750145 Cl\n0.249855 0.750144 0.750145 Cl\n0.249855 0.750144 0.249855 Cl\n0.750145 0.249855 0.750145 Cl\n0.750145 0.750144 0.249855 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Au",
"Cl"
],
"chemical_system": "Au-Cl-Rb-Sb",
"density": 3.8929362546053596,
"density_atomic": 0.03337766517015994,
"volume": 299.60154339795247,
"volume_molar": 18.042426662557183,
"formula_full": "Rb2 Sb1 Au1 Cl6",
"formula_reduced": "Rb2SbAuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110701",
"created_at": "2022-09-04T14:38:37.417871Z",
"updated_at": "2022-09-04T14:38:37.417885Z",
"structure_string": "Rb2 Sb1 Au1 Br6\n1.0\n6.832795 -0.000000 3.944916\n2.277598 6.442021 3.944916\n-0.000000 -0.000000 7.889832\nRb Sb Au Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500001 0.500000 0.500000 Au\n0.748290 0.251710 0.251711 Br\n0.251711 0.251710 0.748290 Br\n0.251711 0.748290 0.748290 Br\n0.251711 0.748290 0.251711 Br\n0.748290 0.251710 0.748290 Br\n0.748290 0.748290 0.251711 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Sb",
"Au",
"Br"
],
"chemical_system": "Au-Br-Rb-Sb",
"density": 4.6336498204150285,
"density_atomic": 0.028794644226040153,
"volume": 347.28680519541194,
"volume_molar": 20.9141002497747,
"formula_full": "Rb2 Sb1 Au1 Br6",
"formula_reduced": "Rb2SbAuBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-9786",
"created_at": "2022-09-04T14:37:17.163725Z",
"updated_at": "2022-09-04T14:37:17.163746Z",
"structure_string": "Rb2 S2 O4 F2\n1.0\n0.000000 4.812394 -0.079858\n5.835008 0.000000 0.000000\n0.000000 -2.112173 -6.675416\nRb S O F\n2 2 4 2\ndirect\n0.840307 0.750000 0.718126 Rb\n0.159693 0.250000 0.281875 Rb\n0.600988 0.750000 0.176525 S\n0.399012 0.250000 0.823476 S\n0.669326 0.541329 0.298926 O\n0.330674 0.041329 0.701075 O\n0.330674 0.458671 0.701075 O\n0.669326 0.958672 0.298926 O\n0.802418 0.250000 0.869947 F\n0.197582 0.750000 0.130054 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"S",
"O",
"F"
],
"chemical_system": "F-O-Rb-S",
"density": 2.9703047937420983,
"density_atomic": 0.05306946310613746,
"volume": 188.4322812914138,
"volume_molar": 11.347657216648086,
"formula_full": "Rb2 S2 O4 F2",
"formula_reduced": "RbSO2F",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.8176074565,
"spacegroup": 11
},
{
"id": "jvasp-34663",
"created_at": "2022-09-04T14:37:14.949678Z",
"updated_at": "2022-09-04T14:37:14.949711Z",
"structure_string": "Rb2 S2 O8 F2\n1.0\n5.492050 0.025328 0.057022\n-0.359228 5.501961 -0.010196\n-2.087658 -1.501493 7.016097\nRb S O F\n2 2 8 2\ndirect\n0.107947 0.336226 0.245272 Rb\n0.892052 0.663775 0.754728 Rb\n0.381809 0.225305 0.790777 S\n0.618191 0.774696 0.209222 S\n0.160604 0.185642 0.856579 O\n0.648570 0.615798 0.345911 O\n0.371304 0.738933 0.067846 O\n0.351429 0.384203 0.654089 O\n0.568919 0.054009 0.317692 O\n0.431080 0.945992 0.682308 O\n0.839396 0.814358 0.143421 O\n0.628695 0.261067 0.932153 O\n0.796242 0.149014 0.488703 F\n0.203757 0.850987 0.511297 F\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "F-O-Rb-S",
"density": 3.131454281176245,
"density_atomic": 0.0658291513200705,
"volume": 212.67173766117764,
"volume_molar": 9.148136713352892,
"formula_full": "Rb2 S2 O8 F2",
"formula_reduced": "RbSO4F",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.5058306117857143,
"spacegroup": 2
},
{
"id": "jvasp-112535",
"created_at": "2022-09-04T14:38:42.106061Z",
"updated_at": "2022-09-04T14:38:42.106073Z",
"structure_string": "Rb4 S4 N2 O12\n1.0\n7.311946 0.099435 0.483811\n3.464633 6.439780 0.483811\n0.027724 0.016823 7.599310\nRb S N O\n4 4 2 12\ndirect\n0.294663 -0.009084 0.150538 Rb\n0.009084 0.705337 0.349462 Rb\n0.705337 0.009085 0.849462 Rb\n-0.009085 0.294663 0.650538 Rb\n0.778331 0.425681 0.142676 S\n0.574320 0.221669 0.357324 S\n0.221669 0.574319 0.857324 S\n0.425680 0.778331 0.642676 S\n0.562128 0.437872 0.250000 N\n0.437871 0.562128 0.750000 N\n0.631981 0.066610 0.222103 O\n0.933391 0.368020 0.277897 O\n0.637303 0.704783 0.567640 O\n0.295217 0.362696 0.932360 O\n0.362696 0.295218 0.432360 O\n0.848307 0.265770 0.010228 O\n0.265769 0.848307 0.510228 O\n0.151693 0.734230 -0.010228 O\n0.734230 0.151693 0.489772 O\n0.066609 0.631980 0.722103 O\n0.704782 0.637304 0.067640 O\n0.368019 0.933391 0.777897 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
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"S",
"N",
"O"
],
"chemical_system": "N-O-Rb-S",
"density": 3.22728928595151,
"density_atomic": 0.061954936498013,
"volume": 355.0968049286206,
"volume_molar": 9.72019519412007,
"formula_full": "Rb4 S4 N2 O12",
"formula_reduced": "Rb2S2NO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.24085675,
"spacegroup": 15
},
{
"id": "jvasp-38034",
"created_at": "2022-09-04T14:37:56.847447Z",
"updated_at": "2022-09-04T14:37:56.847467Z",
"structure_string": "Rb2 S1 Cl6 F1\n1.0\n-0.000000 4.927394 4.927394\n4.927394 0.000000 4.927394\n4.927394 4.927394 -0.000000\nRb S Cl F\n2 1 6 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.749999 0.749999 0.749999 Rb\n0.000000 0.000000 0.000000 S\n0.234863 0.765136 0.765136 Cl\n0.234863 0.765136 0.234863 Cl\n0.765136 0.234863 0.765136 Cl\n0.765136 0.765136 0.234863 Cl\n0.234863 0.234863 0.765136 Cl\n0.765136 0.234863 0.234863 Cl\n0.500000 0.500000 0.500000 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"S",
"Cl",
"F"
],
"chemical_system": "Cl-F-Rb-S",
"density": 3.016989911715409,
"density_atomic": 0.04179440369800767,
"volume": 239.2664834329649,
"volume_molar": 14.408964423835226,
"formula_full": "Rb2 S1 Cl6 F1",
"formula_reduced": "Rb2SCl6F",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-38055",
"created_at": "2022-09-04T14:38:06.220401Z",
"updated_at": "2022-09-04T14:38:06.220423Z",
"structure_string": "Rb2 S1 Br1 Cl6\n1.0\n-0.000000 5.246253 5.246253\n5.246253 0.000000 5.246253\n5.246253 5.246253 -0.000000\nRb S Br Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.500000 Br\n0.224325 0.775674 0.775674 Cl\n0.224325 0.775674 0.224325 Cl\n0.775674 0.224325 0.775674 Cl\n0.775674 0.775674 0.224325 Cl\n0.224325 0.224325 0.775674 Cl\n0.775674 0.224325 0.224325 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Br",
"Cl"
],
"chemical_system": "Br-Cl-Rb-S",
"density": 2.8498533462685978,
"density_atomic": 0.03462759366202714,
"volume": 288.7870320300677,
"volume_molar": 17.391161565476963,
"formula_full": "Rb2 S1 Br1 Cl6",
"formula_reduced": "Rb2SBrCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}