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=-updated_at&page=951",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=949",
"results": [
{
"id": "jvasp-109912",
"created_at": "2022-09-04T14:38:18.310722Z",
"updated_at": "2022-09-04T14:38:18.310742Z",
"structure_string": "Sr2 Cl4 O4\n1.0\n5.535417 -0.103865 1.142866\n2.466866 4.956430 1.142866\n0.146439 0.088800 7.337381\nSr Cl O\n2 4 4\ndirect\n0.644539 0.355461 0.250000 Sr\n0.355463 0.644538 0.750000 Sr\n0.710704 0.932862 0.731210 Cl\n0.067138 0.289297 0.768791 Cl\n0.289298 0.067137 0.268791 Cl\n0.932864 0.710701 0.231210 Cl\n0.231024 0.593016 0.093425 O\n0.406985 0.768976 0.406576 O\n0.768978 0.406983 0.906576 O\n0.593017 0.231023 0.593425 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sr",
"Cl",
"O"
],
"chemical_system": "Cl-O-Sr",
"density": 3.131958982922508,
"density_atomic": 0.049497750046775466,
"volume": 202.02938498315544,
"volume_molar": 12.166493940247921,
"formula_full": "Sr2 Cl4 O4",
"formula_reduced": "Sr(ClO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7778596317499998,
"spacegroup": 15
},
{
"id": "jvasp-16678",
"created_at": "2022-09-04T14:38:18.300455Z",
"updated_at": "2022-09-04T14:38:18.300487Z",
"structure_string": "Hg2 Rh1\n1.0\n4.631190 0.000000 0.000000\n0.000000 4.631190 -0.000000\n0.000000 -0.000000 3.066325\nHg Rh\n2 1\ndirect\n0.000000 0.500000 0.499999 Hg\n0.500000 0.000000 0.499999 Hg\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hg",
"Rh"
],
"chemical_system": "Hg-Rh",
"density": 12.727699736162725,
"density_atomic": 0.04561607071935695,
"volume": 65.76629579642784,
"volume_molar": 13.201796351662825,
"formula_full": "Hg2 Rh1",
"formula_reduced": "Hg2Rh",
"formula_anonymous": "AB2",
"energy_above_hull": 0.3168758888888889,
"spacegroup": 123
},
{
"id": "jvasp-59887",
"created_at": "2022-09-04T14:38:18.297154Z",
"updated_at": "2022-09-04T14:38:18.297175Z",
"structure_string": "Li2 Cr4 S8\n1.0\n6.243404 0.024173 -3.271543\n-1.711497 5.989877 -3.297852\n-0.289154 -0.403694 7.031655\nLi Cr S\n2 4 8\ndirect\n-0.000000 0.500001 0.000001 Li\n0.000001 0.000000 0.500001 Li\n0.377511 0.627511 0.750001 Cr\n0.622489 0.372490 0.250000 Cr\n0.500001 0.000000 0.500001 Cr\n0.000000 0.000000 0.000000 Cr\n0.750649 0.764901 0.514309 S\n0.750594 0.236344 0.985696 S\n0.245531 0.240424 0.005037 S\n0.249351 0.235100 0.485694 S\n0.264612 0.759505 0.505037 S\n0.249406 0.763658 0.014308 S\n0.735386 0.240495 0.494964 S\n0.754468 0.759577 0.994965 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Cr",
"S"
],
"chemical_system": "Cr-Li-S",
"density": 3.2155942338761427,
"density_atomic": 0.0566710624595389,
"volume": 247.0396599674745,
"volume_molar": 10.626482897333348,
"formula_full": "Li2 Cr4 S8",
"formula_reduced": "Li(CrS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.801997828571429,
"spacegroup": 74
},
{
"id": "jvasp-52116",
"created_at": "2022-09-04T14:38:18.295041Z",
"updated_at": "2022-09-04T14:38:18.295052Z",
"structure_string": "Cr1 P2 O7\n1.0\n4.993990 -0.027269 -0.721812\n0.982321 4.896501 0.721812\n-0.003778 0.004637 4.484361\nCr P O\n1 2 7\ndirect\n0.111021 0.111020 0.000000 Cr\n0.263284 0.667030 0.590822 P\n0.667030 0.263285 0.409178 P\n0.551600 0.551601 0.499999 O\n0.149198 0.428158 0.731935 O\n0.073950 0.811584 0.291285 O\n0.332211 0.858472 0.814425 O\n0.811582 0.073950 0.708716 O\n0.858473 0.332210 0.185573 O\n0.428158 0.149199 0.268065 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Cr",
"P",
"O"
],
"chemical_system": "Cr-O-P",
"density": 3.418717655901123,
"density_atomic": 0.09112176434356398,
"volume": 109.74326575038832,
"volume_molar": 6.608893938109254,
"formula_full": "Cr1 P2 O7",
"formula_reduced": "CrP2O7",
"formula_anonymous": "AB2C7",
"energy_above_hull": 3.09605129,
"spacegroup": 5
},
{
"id": "jvasp-58437",
"created_at": "2022-09-04T14:38:18.295006Z",
"updated_at": "2022-09-04T14:38:18.295021Z",
"structure_string": "K2 Yb2 C4 O12\n1.0\n6.277678 -0.178528 -1.437436\n-1.230122 6.158565 -1.437436\n0.064673 0.076621 6.841780\nYb K C O\n2 2 4 12\ndirect\n0.592562 0.407438 0.249999 Yb\n0.407438 0.592561 0.749999 Yb\n0.130465 0.869535 0.249999 K\n0.869535 0.130464 0.749999 K\n0.139950 0.391195 0.244498 C\n0.391195 0.139949 0.744498 C\n0.860050 0.608804 0.755501 C\n0.608805 0.860049 0.255501 C\n0.057720 0.588012 0.787961 O\n0.588013 0.057720 0.287961 O\n0.942280 0.411987 0.212038 O\n0.241224 0.197888 0.625206 O\n0.758776 0.802111 0.374792 O\n0.197888 0.241224 0.125206 O\n0.527799 0.290111 0.894847 O\n0.709889 0.472200 0.605151 O\n0.472201 0.709888 0.105151 O\n0.290111 0.527799 0.394847 O\n0.411987 0.942279 0.712038 O\n0.802112 0.758775 0.874792 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Yb",
"K",
"C",
"O"
],
"chemical_system": "C-K-O-Yb",
"density": 4.171725614286744,
"density_atomic": 0.07563527772036736,
"volume": 264.4268733162108,
"volume_molar": 7.962079259184548,
"formula_full": "K2 Yb2 C4 O12",
"formula_reduced": "KYb(CO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.77023497,
"spacegroup": 15
},
{
"id": "jvasp-30691",
"created_at": "2022-09-04T14:38:18.294677Z",
"updated_at": "2022-09-04T14:38:18.294704Z",
"structure_string": "Bi2 F10\n1.0\n3.822652 -0.000000 0.000000\n-1.911326 5.502316 0.000000\n0.000000 0.000000 8.819346\nBi F\n2 10\ndirect\n0.500000 0.000000 0.500000 Bi\n0.500000 0.000000 0.000000 Bi\n0.462246 0.924493 0.250000 F\n0.537753 0.075508 0.750000 F\n0.083999 0.167999 0.583851 F\n0.915999 0.832002 0.416150 F\n0.331281 0.662562 0.908549 F\n0.668718 0.337438 0.091452 F\n0.668718 0.337438 0.408549 F\n0.331281 0.662562 0.591452 F\n0.083999 0.167999 0.916150 F\n0.915999 0.832002 0.083851 F\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Bi",
"F"
],
"chemical_system": "Bi-F",
"density": 5.4421009745709075,
"density_atomic": 0.06468961600185104,
"volume": 185.50117842184486,
"volume_molar": 9.309285063351869,
"formula_full": "Bi2 F10",
"formula_reduced": "BiF5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.1042050941666666,
"spacegroup": 63
},
{
"id": "jvasp-109556",
"created_at": "2022-09-04T14:38:18.285371Z",
"updated_at": "2022-09-04T14:38:18.285392Z",
"structure_string": "Li1 Nd1 In2\n1.0\n4.520010 -0.000000 2.609629\n1.506670 4.261507 2.609629\n-0.000000 -0.000000 5.219258\nLi Nd In\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Nd\n0.250000 0.250000 0.250000 In\n0.750000 0.750001 0.750000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Nd",
"In"
],
"chemical_system": "In-Li-Nd",
"density": 6.290082452784633,
"density_atomic": 0.03978768069425691,
"volume": 100.53363076720815,
"volume_molar": 15.135691889849857,
"formula_full": "Li1 Nd1 In2",
"formula_reduced": "LiNdIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2258353600000001,
"spacegroup": 225
},
{
"id": "jvasp-110095",
"created_at": "2022-09-04T14:38:18.284073Z",
"updated_at": "2022-09-04T14:38:18.284093Z",
"structure_string": "Sr2 As2 Au2\n1.0\n4.534924 0.000000 0.000000\n-2.267462 3.927360 0.000000\n-0.000000 -0.000000 8.455888\nSr As Au\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.333333 0.666667 0.250000 As\n0.666666 0.333333 0.750000 As\n0.333333 0.666667 0.750000 Au\n0.666666 0.333333 0.250000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"As",
"Au"
],
"chemical_system": "As-Au-Sr",
"density": 7.927895346917478,
"density_atomic": 0.03984018098307942,
"volume": 150.60172549287034,
"volume_molar": 15.11574649361576,
"formula_full": "Sr2 As2 Au2",
"formula_reduced": "SrAsAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3105385433333334,
"spacegroup": 194
},
{
"id": "jvasp-49161",
"created_at": "2022-09-04T14:38:18.283210Z",
"updated_at": "2022-09-04T14:38:18.283228Z",
"structure_string": "Sm4 Sb4 O16\n1.0\n0.000000 7.652482 -0.025640\n5.487864 0.000000 0.000000\n0.000000 -1.260219 -7.576660\nSm Sb O\n4 4 16\ndirect\n0.104604 0.273625 0.853640 Sm\n0.395396 0.773625 0.146360 Sm\n0.895396 0.726374 0.146360 Sm\n0.604604 0.226375 0.853640 Sm\n0.305178 0.769735 0.662928 Sb\n0.194822 0.269735 0.337072 Sb\n0.694822 0.230265 0.337072 Sb\n0.805178 0.730264 0.662928 Sb\n0.694882 0.406164 0.565736 O\n0.805117 0.906164 0.434264 O\n0.375453 0.500442 0.827985 O\n0.124547 0.000442 0.172015 O\n0.624547 0.499557 0.172015 O\n0.875453 -0.000442 0.827985 O\n0.559293 0.872574 0.668118 O\n0.827557 0.520040 0.882797 O\n0.440707 0.127425 0.331882 O\n0.059293 0.627424 0.668118 O\n0.194882 0.093835 0.565736 O\n0.672443 0.020041 0.117203 O\n0.172443 0.479959 0.117203 O\n0.327557 0.979958 0.882797 O\n0.940706 0.372575 0.331882 O\n0.305118 0.593835 0.434264 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sm",
"Sb",
"O"
],
"chemical_system": "O-Sb-Sm",
"density": 7.012533110445105,
"density_atomic": 0.07538515357099122,
"volume": 318.3650740646018,
"volume_molar": 7.988497037853573,
"formula_full": "Sm4 Sb4 O16",
"formula_reduced": "SmSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.940589829166667,
"spacegroup": 14
},
{
"id": "jvasp-25579",
"created_at": "2022-09-04T14:38:18.282604Z",
"updated_at": "2022-09-04T14:38:18.282629Z",
"structure_string": "Nb6 Sn2 S12\n1.0\n2.925960 -5.067912 0.000000\n2.925960 5.067912 -0.000000\n-0.000000 -0.000000 14.549861\nNb Sn S\n6 2 12\ndirect\n0.333333 0.666667 0.999425 Nb\n0.000000 0.000000 0.000000 Nb\n0.666667 0.333333 0.000575 Nb\n0.333333 0.666667 0.500575 Nb\n0.000000 0.000000 0.500000 Nb\n0.666667 0.333333 0.499425 Nb\n0.333333 0.666667 0.250000 Sn\n0.666667 0.333333 0.750000 Sn\n0.330769 0.333007 0.891974 S\n-0.002238 0.666993 0.108026 S\n0.330769 -0.002238 0.608026 S\n0.002238 0.333007 0.608026 S\n0.333007 0.002238 0.391974 S\n0.666993 0.669231 0.608026 S\n0.666993 -0.002238 0.891974 S\n0.002238 0.669231 0.891974 S\n-0.002238 0.330769 0.391974 S\n0.669231 0.666993 0.391974 S\n0.669231 0.002238 0.108026 S\n0.333007 0.330769 0.108026 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nb",
"Sn",
"S"
],
"chemical_system": "Nb-S-Sn",
"density": 4.539538093569499,
"density_atomic": 0.04634935616756166,
"volume": 431.5054545244648,
"volume_molar": 12.992932929270529,
"formula_full": "Nb6 Sn2 S12",
"formula_reduced": "Nb3SnS6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 3.27526799,
"spacegroup": 182
},
{
"id": "jvasp-109065",
"created_at": "2022-09-04T14:38:18.281979Z",
"updated_at": "2022-09-04T14:38:18.281997Z",
"structure_string": "Nd3 Dy1\n1.0\n5.111187 -0.000000 0.000000\n0.000000 5.111187 0.000000\n-0.000000 -0.000000 5.111187\nNd Dy\n3 1\ndirect\n-0.000000 0.500000 0.500000 Nd\n0.500000 0.000000 0.500000 Nd\n0.500000 0.500000 -0.000000 Nd\n0.000000 0.000000 0.000000 Dy\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nd",
"Dy"
],
"chemical_system": "Dy-Nd",
"density": 7.4022829050955306,
"density_atomic": 0.02995674894257446,
"volume": 133.52583778926723,
"volume_molar": 20.102784756597362,
"formula_full": "Nd3 Dy1",
"formula_reduced": "Nd3Dy",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5778752500000002,
"spacegroup": 221
},
{
"id": "jvasp-109890",
"created_at": "2022-09-04T14:38:18.263814Z",
"updated_at": "2022-09-04T14:38:18.263832Z",
"structure_string": "Na3 Ga1 F6\n1.0\n4.958213 -0.000000 2.862626\n1.652738 4.674648 2.862626\n-0.000000 -0.000000 5.725251\nNa Ga F\n3 1 6\ndirect\n0.750000 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Ga\n0.765216 0.234784 0.234784 F\n0.234783 0.234784 0.765217 F\n0.234784 0.765217 0.765217 F\n0.234784 0.765217 0.234784 F\n0.765216 0.234784 0.765217 F\n0.765216 0.765217 0.234785 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Ga",
"F"
],
"chemical_system": "F-Ga-Na",
"density": 3.161957495397351,
"density_atomic": 0.0753583489621987,
"volume": 132.6992979240589,
"volume_molar": 7.9913385085185835,
"formula_full": "Na3 Ga1 F6",
"formula_reduced": "Na3GaF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}