HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=197",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=195",
"results": [
{
"id": "jvasp-110132",
"created_at": "2022-09-04T14:38:20.502749Z",
"updated_at": "2022-09-04T14:38:20.502761Z",
"structure_string": "Y2 Fe2 Cu2\n1.0\n4.453652 0.048913 -2.605777\n-1.379182 4.123044 -2.779541\n0.020232 -0.048913 5.159911\nY Fe Cu\n2 2 2\ndirect\n0.368741 0.118741 0.249999 Y\n0.631258 0.881258 0.749999 Y\n0.000000 0.499999 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n0.500000 0.499999 -0.000001 Cu\n-0.000000 0.500000 0.500000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Fe",
"Cu"
],
"chemical_system": "Cu-Fe-Y",
"density": 7.317932247997644,
"density_atomic": 0.0634713651475976,
"volume": 94.53081694473528,
"volume_molar": 9.487964763316482,
"formula_full": "Y2 Fe2 Cu2",
"formula_reduced": "YFeCu",
"formula_anonymous": "ABC",
"energy_above_hull": 1.719717133333333,
"spacegroup": 74
},
{
"id": "jvasp-110131",
"created_at": "2022-09-04T14:38:20.178712Z",
"updated_at": "2022-09-04T14:38:20.178732Z",
"structure_string": "Y2 Fe2 Co2\n1.0\n4.476864 -0.028042 2.379331\n-2.991418 4.091948 0.108109\n-0.028411 -0.028042 5.069785\nY Fe Co\n2 2 2\ndirect\n0.500000 0.751253 0.748747 Y\n0.000000 -0.001252 0.001252 Y\n0.250000 0.875001 0.375000 Fe\n0.750000 0.375001 0.375000 Fe\n0.750000 0.375001 0.874999 Co\n0.250000 0.375001 0.375000 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Fe",
"Co"
],
"chemical_system": "Co-Fe-Y",
"density": 7.278479588806806,
"density_atomic": 0.06455885430456113,
"volume": 92.9384522794435,
"volume_molar": 9.32814069405586,
"formula_full": "Y2 Fe2 Co2",
"formula_reduced": "YFeCo",
"formula_anonymous": "ABC",
"energy_above_hull": 2.7784706166666666,
"spacegroup": 74
},
{
"id": "jvasp-16719",
"created_at": "2022-09-04T14:38:07.179502Z",
"updated_at": "2022-09-04T14:38:07.179525Z",
"structure_string": "Y1 Fe2 B2\n1.0\n3.413853 -0.000000 -1.187774\n-0.413260 3.388747 -1.187774\n-0.054840 -0.061934 5.342248\nY Fe B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.250000 0.750001 0.500001 Fe\n0.749999 0.250001 0.500001 Fe\n0.659682 0.659683 0.319365 B\n0.340318 0.340319 0.680637 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"Fe",
"B"
],
"chemical_system": "B-Fe-Y",
"density": 6.019549080418232,
"density_atomic": 0.08156539154378142,
"volume": 61.30050877419226,
"volume_molar": 7.383205849956017,
"formula_full": "Y1 Fe2 B2",
"formula_reduced": "Y(FeB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.888912323333333,
"spacegroup": 139
},
{
"id": "jvasp-94425",
"created_at": "2022-09-04T14:36:05.342585Z",
"updated_at": "2022-09-04T14:36:05.342614Z",
"structure_string": "Y1 Fe5\n1.0\n0.000000 0.000000 -3.917320\n-2.490737 -4.314054 0.000000\n-2.490606 4.313978 0.000000\nY Fe\n1 5\ndirect\n0.000000 0.999981 0.000001 Y\n0.500000 0.499988 0.000001 Fe\n0.500000 0.499986 0.500002 Fe\n0.500000 0.999985 0.500000 Fe\n0.000000 0.333326 0.666694 Fe\n0.000000 0.666633 0.333308 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"Fe"
],
"chemical_system": "Fe-Y",
"density": 7.261629100620541,
"density_atomic": 0.07127447092135003,
"volume": 84.1816140118512,
"volume_molar": 8.449225483055937,
"formula_full": "Y1 Fe5",
"formula_reduced": "YFe5",
"formula_anonymous": "AB5",
"energy_above_hull": 3.697285491666666,
"spacegroup": 191
},
{
"id": "jvasp-16514",
"created_at": "2022-09-04T14:37:39.961914Z",
"updated_at": "2022-09-04T14:37:39.961939Z",
"structure_string": "Y1 Fe5\n1.0\n2.490715 -4.314045 0.000000\n2.490715 4.314045 0.000000\n0.000000 0.000000 3.918194\nY Fe\n1 5\ndirect\n0.000000 0.000000 0.000000 Y\n0.333334 0.666668 0.000000 Fe\n0.666668 0.333334 0.000000 Fe\n0.500001 0.500001 0.499999 Fe\n0.500001 0.000000 0.499999 Fe\n0.000000 0.500001 0.499999 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"Fe"
],
"chemical_system": "Fe-Y",
"density": 7.259833708106247,
"density_atomic": 0.07125684875285596,
"volume": 84.20243253824106,
"volume_molar": 8.451315017994862,
"formula_full": "Y1 Fe5",
"formula_reduced": "YFe5",
"formula_anonymous": "AB5",
"energy_above_hull": 3.697357158333333,
"spacegroup": 191
},
{
"id": "jvasp-19159",
"created_at": "2022-09-04T14:38:35.712992Z",
"updated_at": "2022-09-04T14:38:35.713012Z",
"structure_string": "Y1 Fe4 Cu3 O12\n1.0\n5.899322 -0.000037 -2.085800\n-2.949649 5.108876 -2.085669\n-0.000062 0.000052 6.257224\nY Fe Cu O\n1 4 3 12\ndirect\n-0.000000 0.000000 0.000001 Y\n0.500000 -0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.500000 1.000000 0.500000 Cu\n0.500001 0.500000 0.000000 Cu\n0.000000 0.500001 0.500000 Cu\n0.700021 0.522700 0.822670 O\n0.177337 0.299990 0.477333 O\n0.522670 0.822663 0.700006 O\n0.700010 0.877351 0.177339 O\n0.122654 0.822665 0.299983 O\n0.177346 0.699999 0.877346 O\n0.299980 0.477301 0.177329 O\n0.822662 0.700010 0.522666 O\n0.877345 0.177334 0.700017 O\n0.822653 0.300001 0.122653 O\n0.477329 0.177336 0.299994 O\n0.299991 0.122649 0.822661 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Y",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-O-Y",
"density": 6.118902496296505,
"density_atomic": 0.10605269608131312,
"volume": 188.5854932406954,
"volume_molar": 5.67844192794748,
"formula_full": "Y1 Fe4 Cu3 O12",
"formula_reduced": "YFe4(CuO4)3",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.72343854,
"spacegroup": 204
},
{
"id": "jvasp-121984",
"created_at": "2022-09-04T14:38:54.337294Z",
"updated_at": "2022-09-04T14:38:54.337319Z",
"structure_string": "Y1 Fe4 Cu3 O12\n1.0\n5.884224 0.003899 2.076573\n-2.943183 5.094601 2.078152\n0.002911 0.003918 6.239875\nY Fe Cu O\n1 4 3 12\ndirect\n0.000000 0.000000 0.999999 Y\n0.500000 -0.000000 -0.000000 Fe\n-0.000000 0.000000 0.500000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.499999 Fe\n0.500001 0.000001 0.499999 Cu\n0.500001 0.500001 -0.000000 Cu\n0.000000 0.500000 0.499999 Cu\n0.522681 0.822674 0.299996 O\n0.477319 0.177327 0.700002 O\n0.822712 0.700032 0.477258 O\n0.177288 0.299968 0.522740 O\n0.177298 0.700031 0.122679 O\n0.300025 0.477348 0.822672 O\n0.300020 0.122699 0.177318 O\n0.699979 0.877300 0.822680 O\n0.122670 0.822674 0.700000 O\n0.699975 0.522652 0.177325 O\n0.822702 0.299970 0.877320 O\n0.877329 0.177326 0.299999 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Y",
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-O-Y",
"density": 6.169906538665957,
"density_atomic": 0.10693669712686008,
"volume": 187.02653567347232,
"volume_molar": 5.63150061840406,
"formula_full": "Y1 Fe4 Cu3 O12",
"formula_reduced": "YFe4(CuO4)3",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.72275654,
"spacegroup": 204
},
{
"id": "jvasp-99440",
"created_at": "2022-09-04T14:36:31.468323Z",
"updated_at": "2022-09-04T14:36:31.468352Z",
"structure_string": "Y2 Fe4 Si2 C2\n1.0\n5.560066 -0.011203 0.000000\n-4.290892 3.535917 0.000000\n0.000000 -0.000000 6.732878\nY Fe Si C\n2 4 2 2\ndirect\n0.550535 0.449468 0.250000 Y\n0.449468 0.550534 0.750000 Y\n0.835141 0.164861 0.062190 Fe\n0.164861 0.835141 0.937810 Fe\n0.164861 0.835141 0.562190 Fe\n0.835141 0.164861 0.437810 Fe\n0.270537 0.729465 0.250000 Si\n0.729466 0.270536 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Y",
"Fe",
"Si",
"C"
],
"chemical_system": "C-Fe-Si-Y",
"density": 6.05370546038656,
"density_atomic": 0.07573217813930076,
"volume": 132.04426765074857,
"volume_molar": 7.951891663439224,
"formula_full": "Y2 Fe4 Si2 C2",
"formula_reduced": "YFe2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.91709101,
"spacegroup": 63
},
{
"id": "jvasp-28395",
"created_at": "2022-09-04T14:36:53.874347Z",
"updated_at": "2022-09-04T14:36:53.874376Z",
"structure_string": "Y1 Fe2 Bi2 Se2 O4\n1.0\n3.814006 -0.000000 -0.595983\n-0.093126 3.812807 -0.595961\n0.065357 0.067038 12.920174\nY Fe Bi Se O\n1 2 2 2 4\ndirect\n0.999993 0.999983 0.999986 Y\n0.250010 0.750075 0.500020 Fe\n0.750009 0.249985 0.500017 Fe\n0.399552 0.399549 0.799100 Bi\n0.600440 0.600420 0.200879 Bi\n0.812986 0.812961 0.625972 Se\n0.187032 0.187095 0.374064 Se\n0.554844 0.054827 0.109685 O\n0.945148 0.445144 0.890294 O\n0.054844 0.554825 0.109687 O\n0.445149 0.945144 0.890297 O\n",
"nsites": 11,
"nelements": 5,
"elements": [
"Y",
"Fe",
"Bi",
"Se",
"O"
],
"chemical_system": "Bi-Fe-O-Se-Y",
"density": 7.416097255521327,
"density_atomic": 0.05845135616687391,
"volume": 188.19067206235363,
"volume_molar": 10.30282469889539,
"formula_full": "Y1 Fe2 Bi2 Se2 O4",
"formula_reduced": "YFe2Bi2(SeO2)2",
"formula_anonymous": "AB2C2D2E4",
"energy_above_hull": 2.504320525757576,
"spacegroup": 139
},
{
"id": "jvasp-19763",
"created_at": "2022-09-04T14:38:10.980886Z",
"updated_at": "2022-09-04T14:38:10.980912Z",
"structure_string": "Y2 Fe4\n1.0\n4.422621 0.000000 2.553402\n1.474207 4.169687 2.553402\n-0.000000 -0.000000 5.106804\nY Fe\n2 4\ndirect\n0.875000 0.875001 0.874998 Y\n0.125000 0.125000 0.125000 Y\n0.500000 -0.000000 0.500000 Fe\n0.000000 0.500000 0.499999 Fe\n0.500000 0.500000 0.499999 Fe\n0.500000 0.500000 -0.000001 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"Fe"
],
"chemical_system": "Fe-Y",
"density": 7.074058839509675,
"density_atomic": 0.06371165419041047,
"volume": 94.17429316884832,
"volume_molar": 9.452180823938518,
"formula_full": "Y2 Fe4",
"formula_reduced": "YFe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.849342150000001,
"spacegroup": 227
},
{
"id": "jvasp-14116",
"created_at": "2022-09-04T14:36:13.859281Z",
"updated_at": "2022-09-04T14:36:13.859307Z",
"structure_string": "Y4 F12\n1.0\n4.402399 0.000000 0.000000\n-0.000000 6.407153 0.000000\n0.000000 0.000000 6.900399\nY F\n4 12\ndirect\n0.938406 0.631208 0.750000 Y\n0.438406 0.868791 0.250000 Y\n0.561594 0.131208 0.750000 Y\n0.061594 0.368791 0.250000 Y\n0.379269 0.165479 0.437008 F\n0.879269 0.334521 0.562992 F\n0.120732 0.665479 0.062992 F\n0.620732 0.834520 0.937008 F\n0.588570 0.522426 0.250000 F\n0.088569 0.977574 0.750000 F\n0.911431 0.022426 0.250000 F\n0.411431 0.477574 0.750000 F\n0.379269 0.165479 0.062992 F\n0.879269 0.334521 0.937008 F\n0.120732 0.665479 0.437008 F\n0.620732 0.834520 0.562992 F\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Y",
"F"
],
"chemical_system": "F-Y",
"density": 4.978962268797482,
"density_atomic": 0.08220368437074525,
"volume": 194.63847785506437,
"volume_molar": 7.325876943470878,
"formula_full": "Y4 F12",
"formula_reduced": "YF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-34568",
"created_at": "2022-09-04T14:37:18.337078Z",
"updated_at": "2022-09-04T14:37:18.337108Z",
"structure_string": "Y3 F9\n1.0\n5.344677 -0.000000 0.000000\n0.000000 5.344677 -0.000000\n-0.000000 0.000000 5.344677\nY F\n3 9\ndirect\n0.000000 0.500000 0.500000 Y\n0.500000 0.500000 0.000000 Y\n0.500000 0.000000 0.500000 Y\n0.242058 0.757942 0.757942 F\n0.757942 0.757942 0.242058 F\n0.757942 0.242058 0.242058 F\n0.757942 0.242058 0.757942 F\n0.500000 0.500000 0.500000 F\n0.242058 0.757942 0.242058 F\n0.242058 0.242058 0.757942 F\n0.757942 0.757942 0.757942 F\n0.242058 0.242058 0.242058 F\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Y",
"F"
],
"chemical_system": "F-Y",
"density": 4.76062974194192,
"density_atomic": 0.07859896974216128,
"volume": 152.6737569126568,
"volume_molar": 7.66185712071702,
"formula_full": "Y3 F9",
"formula_reduced": "YF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0541849999999999,
"spacegroup": 221
}
]
}