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=-created_at&page=3428",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=3426",
"results": [
{
"id": "jvasp-99852",
"created_at": "2022-09-04T14:36:21.416690Z",
"updated_at": "2022-09-04T14:36:21.416710Z",
"structure_string": "Y2 Cd1 Hg1\n1.0\n4.546951 0.000000 2.625184\n1.515650 4.286907 2.625184\n0.000000 0.000000 5.250367\nY Cd Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Y\n0.750000 0.750000 0.749999 Y\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg-Y",
"density": 7.9636266542725735,
"density_atomic": 0.03908462897450744,
"volume": 102.34202306510214,
"volume_molar": 15.407951714030295,
"formula_full": "Y2 Cd1 Hg1",
"formula_reduced": "Y2CdHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7867932624999997,
"spacegroup": 225
},
{
"id": "jvasp-66363",
"created_at": "2022-09-04T14:36:21.410974Z",
"updated_at": "2022-09-04T14:36:21.411007Z",
"structure_string": "Ba1 Te1 Br1\n1.0\n0.000000 4.002571 4.002571\n4.002571 -0.000000 4.002571\n4.002571 4.002571 0.000000\nBa Te Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Te\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Te",
"Br"
],
"chemical_system": "Ba-Br-Te",
"density": 4.464864362890016,
"density_atomic": 0.02339236467451302,
"volume": 128.24697467497282,
"volume_molar": 25.744044451228053,
"formula_full": "Ba1 Te1 Br1",
"formula_reduced": "BaTeBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-16225",
"created_at": "2022-09-04T14:36:21.401708Z",
"updated_at": "2022-09-04T14:36:21.401722Z",
"structure_string": "Sc2 Ge2\n1.0\n3.790599 0.000000 -0.000000\n-0.000000 3.719391 -1.481472\n-0.000000 0.010369 5.435731\nSc Ge\n2 2\ndirect\n0.750000 0.135314 0.270627 Sc\n0.250000 0.864686 0.729374 Sc\n0.750000 0.407825 0.815650 Ge\n0.250000 0.592175 0.184350 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sc",
"Ge"
],
"chemical_system": "Ge-Sc",
"density": 5.09218096407078,
"density_atomic": 0.05215458603973273,
"volume": 76.69507714916375,
"volume_molar": 11.54671375478309,
"formula_full": "Sc2 Ge2",
"formula_reduced": "ScGe",
"formula_anonymous": "AB",
"energy_above_hull": 0.7072756,
"spacegroup": 63
},
{
"id": "jvasp-65047",
"created_at": "2022-09-04T14:36:21.400696Z",
"updated_at": "2022-09-04T14:36:21.400721Z",
"structure_string": "Be1 In4 Pb1\n1.0\n-0.000000 4.366357 4.366357\n4.366357 0.000000 4.366357\n4.366357 4.366357 0.000000\nBe In Pb\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.123866 0.625378 0.625378 In\n0.625378 0.625378 0.625378 In\n0.625378 0.123866 0.625378 In\n0.625378 0.625378 0.123866 In\n0.250000 0.250000 0.250000 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"In",
"Pb"
],
"chemical_system": "Be-In-Pb",
"density": 6.737155339802554,
"density_atomic": 0.036038236459219525,
"volume": 166.489833840497,
"volume_molar": 16.710420241608073,
"formula_full": "Be1 In4 Pb1",
"formula_reduced": "BeIn4Pb",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.1054327999999999,
"spacegroup": 216
},
{
"id": "jvasp-15603",
"created_at": "2022-09-04T14:36:21.391890Z",
"updated_at": "2022-09-04T14:36:21.391907Z",
"structure_string": "Ce1 Ge2 Rh2\n1.0\n3.906600 -0.000000 -1.445184\n-0.534623 3.869845 -1.445184\n-0.002228 -0.002558 5.996697\nCe Ge Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.621899 0.621898 0.243798 Ge\n0.378101 0.378101 0.756204 Ge\n0.250000 0.749999 0.500001 Rh\n0.750000 0.249999 0.500001 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Ge",
"Rh"
],
"chemical_system": "Ce-Ge-Rh",
"density": 9.000101094258005,
"density_atomic": 0.05517009698821683,
"volume": 90.62880569283564,
"volume_molar": 10.915588495858911,
"formula_full": "Ce1 Ge2 Rh2",
"formula_reduced": "Ce(GeRh)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.87492668,
"spacegroup": 139
},
{
"id": "jvasp-105783",
"created_at": "2022-09-04T14:36:21.384236Z",
"updated_at": "2022-09-04T14:36:21.384261Z",
"structure_string": "La3 Zn1\n1.0\n4.946979 0.000000 -0.000000\n0.000000 4.946979 0.000000\n-0.000000 0.000000 4.946979\nLa Zn\n3 1\ndirect\n0.000000 0.500000 0.500000 La\n0.500000 0.000000 0.500000 La\n0.500000 0.500000 0.000000 La\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"La",
"Zn"
],
"chemical_system": "La-Zn",
"density": 6.612853755693696,
"density_atomic": 0.033039981158300084,
"volume": 121.06544434257785,
"volume_molar": 18.226828675073737,
"formula_full": "La3 Zn1",
"formula_reduced": "La3Zn",
"formula_anonymous": "AB3",
"energy_above_hull": 1.3450084999999998,
"spacegroup": 221
},
{
"id": "jvasp-53571",
"created_at": "2022-09-04T14:36:21.377926Z",
"updated_at": "2022-09-04T14:36:21.377938Z",
"structure_string": "Al4 Cr2 S8\n1.0\n6.130676 0.034988 3.593646\n2.076546 5.768395 3.593646\n-0.000000 -0.000000 7.187295\nAl Cr S\n4 2 8\ndirect\n0.991244 0.991242 0.008758 Al\n0.258758 0.258758 0.241242 Al\n0.625001 0.625000 0.125000 Al\n0.625001 0.625000 0.625000 Al\n0.125001 0.625000 0.625000 Cr\n0.625001 0.125000 0.625000 Cr\n0.385074 0.385073 0.379416 S\n0.385074 0.385073 0.850437 S\n0.382561 0.856355 0.380542 S\n0.856357 0.382560 0.380542 S\n0.393645 0.867439 0.869458 S\n0.867441 0.393644 0.869458 S\n0.864928 0.864926 0.399563 S\n0.864928 0.864926 0.870584 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Cr",
"S"
],
"chemical_system": "Al-Cr-S",
"density": 3.0666617381082433,
"density_atomic": 0.05519406315975795,
"volume": 253.65046888244703,
"volume_molar": 10.910848767500685,
"formula_full": "Al4 Cr2 S8",
"formula_reduced": "Al2CrS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.4216932857142863,
"spacegroup": 74
},
{
"id": "jvasp-71418",
"created_at": "2022-09-04T14:36:21.376992Z",
"updated_at": "2022-09-04T14:36:21.377016Z",
"structure_string": "Be1 Cd1 Si1\n1.0\n1.531894 -2.653319 -0.000000\n1.531894 2.653319 0.000000\n0.000000 0.000000 5.923916\nBe Cd Si\n1 1 1\ndirect\n0.000000 0.000000 0.023299 Be\n0.333332 0.666666 0.688805 Cd\n0.666666 0.333332 0.287896 Si\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Si"
],
"chemical_system": "Be-Cd-Si",
"density": 5.155353392918765,
"density_atomic": 0.06229657715214688,
"volume": 48.156738895511104,
"volume_molar": 9.666888672377826,
"formula_full": "Be1 Cd1 Si1",
"formula_reduced": "BeCdSi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0680881499999997,
"spacegroup": 156
},
{
"id": "jvasp-88061",
"created_at": "2022-09-04T14:36:21.374437Z",
"updated_at": "2022-09-04T14:36:21.374459Z",
"structure_string": "Pr2 Zr4 F22\n1.0\n6.960115 -0.000000 3.630119\n3.191395 7.468891 2.368520\n0.014098 -0.013624 8.460428\nPr Zr F\n2 4 22\ndirect\n0.750000 0.250000 0.250000 Pr\n0.250000 0.750000 0.750000 Pr\n0.632944 0.819567 0.180433 Zr\n0.367056 0.180434 0.819567 Zr\n0.867056 0.319567 0.680433 Zr\n0.132944 0.680433 0.319567 Zr\n0.130218 0.280792 0.719209 F\n0.535041 0.176266 0.548545 F\n0.240149 0.676266 0.048545 F\n0.106336 0.204595 0.053679 F\n0.464959 0.823734 0.451455 F\n0.500000 0.000000 0.000000 F\n0.035041 0.048545 0.676266 F\n0.606336 0.553680 0.704595 F\n0.135390 0.704595 0.553679 F\n0.259852 0.451456 0.823734 F\n0.393664 0.446321 0.295405 F\n0.369783 0.780791 0.219209 F\n0.635390 0.053680 0.204595 F\n0.740148 0.548545 0.176266 F\n0.893664 0.795406 0.946321 F\n0.630217 0.219209 0.780791 F\n0.364610 0.946321 0.795405 F\n0.964959 0.951455 0.323734 F\n0.869782 0.719209 0.280791 F\n0.759851 0.323735 0.951456 F\n0.864609 0.295406 0.446321 F\n0.000000 0.500000 0.500000 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Pr",
"Zr",
"F"
],
"chemical_system": "F-Pr-Zr",
"density": 4.02266064532438,
"density_atomic": 0.06370958803215553,
"volume": 439.49428751395834,
"volume_molar": 9.452487366517742,
"formula_full": "Pr2 Zr4 F22",
"formula_reduced": "PrZr2F11",
"formula_anonymous": "AB2C11",
"energy_above_hull": 0.4814051398214288,
"spacegroup": 72
},
{
"id": "jvasp-42815",
"created_at": "2022-09-04T14:36:21.373531Z",
"updated_at": "2022-09-04T14:36:21.373557Z",
"structure_string": "Na4 V2 O6\n1.0\n0.000000 6.316852 0.000000\n-5.480080 3.158426 0.000000\n0.000000 0.000000 4.912066\nNa V O\n4 2 6\ndirect\n0.501050 0.668313 0.007955 Na\n0.830638 0.668313 0.507955 Na\n0.498950 0.331687 0.507955 Na\n0.169363 0.331687 0.007955 Na\n0.830701 0.000000 0.045460 V\n0.169299 0.000000 0.545460 V\n0.838221 0.722824 0.987767 O\n0.438955 0.722824 0.487767 O\n0.561045 0.277176 0.987767 O\n0.161779 0.277176 0.487767 O\n0.886873 0.000000 0.421099 O\n0.113127 0.000000 0.921099 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"V",
"O"
],
"chemical_system": "Na-O-V",
"density": 2.8304360229530467,
"density_atomic": 0.07057151687102402,
"volume": 170.04027307406628,
"volume_molar": 8.533387161007209,
"formula_full": "Na4 V2 O6",
"formula_reduced": "Na2VO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.5042487833333331,
"spacegroup": 36
},
{
"id": "jvasp-96985",
"created_at": "2022-09-04T14:36:21.371911Z",
"updated_at": "2022-09-04T14:36:21.371934Z",
"structure_string": "Al8 Co2 B4 O20\n1.0\n4.387094 0.000000 0.000000\n0.000000 6.873026 -2.301675\n0.000000 -0.000329 9.601406\nAl Co B O\n8 2 4 20\ndirect\n0.519960 0.702738 0.331663 Al\n0.480039 0.297263 0.668339 Al\n0.005618 0.075513 0.391476 Al\n0.994381 0.924488 0.608525 Al\n0.505617 0.924488 0.108525 Al\n0.494382 0.075513 0.891476 Al\n0.019961 0.297263 0.168338 Al\n0.980039 0.702738 0.831663 Al\n0.000000 0.500000 0.500001 Co\n0.500000 0.500000 0.000000 Co\n0.070184 0.708626 0.148893 B\n0.929815 0.291375 0.851108 B\n0.429816 0.708625 0.648893 B\n0.570184 0.291375 0.351108 B\n0.741718 0.120458 0.242897 O\n0.258281 0.879543 0.757104 O\n0.800571 0.288949 0.995515 O\n0.207238 0.541393 0.185443 O\n0.240897 0.281482 0.344611 O\n0.758280 0.120458 0.742898 O\n0.199428 0.711052 0.004486 O\n0.292761 0.541393 0.685443 O\n0.716597 0.887598 0.938528 O\n0.759102 0.718519 0.655390 O\n0.259102 0.281482 0.844611 O\n0.216597 0.112402 0.561473 O\n0.792761 0.458607 0.814559 O\n0.699427 0.288949 0.495515 O\n0.783402 0.887598 0.438528 O\n0.300572 0.711052 0.504486 O\n0.707238 0.458607 0.314558 O\n0.740897 0.718519 0.155390 O\n0.283402 0.112402 0.061473 O\n0.241719 0.879543 0.257103 O\n",
"nsites": 34,
"nelements": 4,
"elements": [
"Al",
"Co",
"B",
"O"
],
"chemical_system": "Al-B-Co-O",
"density": 3.9975727664410026,
"density_atomic": 0.11744218955789529,
"volume": 289.5041392534586,
"volume_molar": 5.12774905054991,
"formula_full": "Al8 Co2 B4 O20",
"formula_reduced": "Al4Co(BO5)2",
"formula_anonymous": "AB2C4D10",
"energy_above_hull": 3.0112966039215685,
"spacegroup": 14
},
{
"id": "jvasp-42431",
"created_at": "2022-09-04T14:36:21.368243Z",
"updated_at": "2022-09-04T14:36:21.368268Z",
"structure_string": "Mn6 O4 F8\n1.0\n4.678277 0.010698 -0.019199\n0.010698 4.678277 -0.019199\n-0.038081 -0.038081 9.562714\nMn O F\n6 4 8\ndirect\n0.982926 0.950668 0.991990 Mn\n0.049333 0.017075 0.341344 Mn\n0.016870 0.983131 0.666667 Mn\n0.484032 0.525370 0.841947 Mn\n0.513926 0.486076 0.166667 Mn\n0.474631 0.515969 0.491386 Mn\n0.680352 0.674881 0.001870 O\n0.325120 0.319649 0.331463 O\n0.203999 0.821481 0.500569 O\n0.178520 0.796003 0.832764 O\n0.793243 0.222313 0.510156 F\n0.210976 0.789026 0.166667 F\n0.279551 0.266248 0.004250 F\n0.295192 0.322348 0.679103 F\n0.733754 0.720450 0.329083 F\n0.677654 0.704809 0.654230 F\n0.822243 0.177759 0.166667 F\n0.777689 0.206758 0.823176 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.329096673355605,
"density_atomic": 0.08600741725175015,
"volume": 209.28427541676612,
"volume_molar": 7.0018853634131855,
"formula_full": "Mn6 O4 F8",
"formula_reduced": "Mn3(OF2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.9813655393486589,
"spacegroup": 5
}
]
}