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=energy_above_hull&page=4101",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=4099",
"results": [
{
"id": "jvasp-28594",
"created_at": "2022-09-04T14:37:47.709233Z",
"updated_at": "2022-09-04T14:37:47.709248Z",
"structure_string": "Te4 Mo2 W2 S4\n1.0\n3.367385 0.000000 0.000000\n-1.683692 2.916029 -0.000000\n0.000000 -0.000010 38.276596\nTe Mo W S\n4 2 2 4\ndirect\n0.333355 0.666712 0.331459 Te\n0.333353 0.666706 0.707074 Te\n0.333353 0.666706 0.232133 Te\n0.333354 0.666708 0.607907 Te\n0.333326 0.666653 0.093923 Mo\n0.333310 0.666619 0.469677 Mo\n0.666692 0.333386 0.281799 W\n0.666692 0.333385 0.657543 W\n0.666638 0.333277 0.054452 S\n0.666648 0.333295 0.430215 S\n0.666636 0.333274 0.133430 S\n0.666641 0.333282 0.509136 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 5.293802585567252,
"density_atomic": 0.031927383288833426,
"volume": 375.8529125747988,
"volume_molar": 18.861992871511767,
"formula_full": "Te4 Mo2 W2 S4",
"formula_reduced": "Te2MoWS2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.5543185722222224,
"spacegroup": 156
},
{
"id": "jvasp-112756",
"created_at": "2022-09-04T14:38:42.147791Z",
"updated_at": "2022-09-04T14:38:42.147826Z",
"structure_string": "V2 Cr4 O8\n1.0\n5.190944 0.033812 -2.936236\n-1.771923 4.853233 2.973163\n-0.056788 -0.013408 5.963229\nV Cr O\n2 4 8\ndirect\n0.124993 0.375049 0.374941 V\n0.875010 0.624952 0.625062 V\n0.499999 0.000002 0.499997 Cr\n0.000002 0.000001 0.000001 Cr\n0.499999 0.499995 0.000002 Cr\n0.500000 0.000001 0.000002 Cr\n0.258932 0.240598 0.777735 O\n0.740584 0.222227 0.759419 O\n0.259410 0.241065 0.240590 O\n0.722241 0.240597 0.241054 O\n0.277760 0.759399 0.758945 O\n0.740585 0.758931 0.759408 O\n0.259411 0.777774 0.240573 O\n0.741068 0.759402 0.222265 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Cr",
"O"
],
"chemical_system": "Cr-O-V",
"density": 4.850153715914763,
"density_atomic": 0.09338918590662305,
"volume": 149.91029061971014,
"volume_molar": 6.448434796317158,
"formula_full": "V2 Cr4 O8",
"formula_reduced": "VCr2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.554870428571429,
"spacegroup": 227
},
{
"id": "jvasp-92575",
"created_at": "2022-09-04T14:36:00.810600Z",
"updated_at": "2022-09-04T14:36:00.810620Z",
"structure_string": "Th1 Si3 Ir1\n1.0\n4.311957 0.000000 0.000000\n0.000000 4.311957 0.000000\n-2.155979 -2.155979 4.879762\nTh Si Ir\n1 3 1\ndirect\n0.000316 0.000316 0.000630 Th\n0.410243 0.410243 0.820485 Si\n0.764132 0.264132 0.528264 Si\n0.264132 0.764132 0.528264 Si\n0.655179 0.655179 0.310356 Ir\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Th",
"Si",
"Ir"
],
"chemical_system": "Ir-Si-Th",
"density": 9.306844212994111,
"density_atomic": 0.05510899880172896,
"volume": 90.72928394124868,
"volume_molar": 10.927690378964144,
"formula_full": "Th1 Si3 Ir1",
"formula_reduced": "ThSi3Ir",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.5554364999999994,
"spacegroup": 107
},
{
"id": "jvasp-65087",
"created_at": "2022-09-04T14:36:11.092981Z",
"updated_at": "2022-09-04T14:36:11.093006Z",
"structure_string": "Be2 V1 Mo1\n1.0\n3.097447 0.000000 0.000000\n0.000000 3.097447 0.000000\n-0.000000 0.000000 5.127350\nBe V Mo\n2 1 1\ndirect\n0.000000 0.000000 0.004917 Be\n0.500000 0.500000 0.244365 Be\n0.500000 0.500000 0.745108 V\n0.000000 0.000000 0.505610 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Mo"
],
"chemical_system": "Be-Mo-V",
"density": 5.566528857606825,
"density_atomic": 0.08131286425738,
"volume": 49.19270814687797,
"volume_molar": 7.406135320652447,
"formula_full": "Be2 V1 Mo1",
"formula_reduced": "Be2VMo",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.555810575,
"spacegroup": 99
},
{
"id": "jvasp-16718",
"created_at": "2022-09-04T14:37:57.245138Z",
"updated_at": "2022-09-04T14:37:57.245164Z",
"structure_string": "Tm1 Fe2 B2\n1.0\n3.376781 -0.000000 -1.186779\n-0.417097 3.350922 -1.186779\n-0.054056 -0.061201 5.243614\nTm Fe B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.249999 0.750000 0.499999 Fe\n0.749999 0.250000 0.499999 Fe\n0.651752 0.651753 0.303507 B\n0.348245 0.348247 0.696491 B\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tm",
"Fe",
"B"
],
"chemical_system": "B-Fe-Tm",
"density": 8.529378992578101,
"density_atomic": 0.08497231595797844,
"volume": 58.84269416020933,
"volume_molar": 7.087179738608211,
"formula_full": "Tm1 Fe2 B2",
"formula_reduced": "Tm(FeB)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.5558160833333328,
"spacegroup": 139
},
{
"id": "jvasp-65155",
"created_at": "2022-09-04T14:35:57.604638Z",
"updated_at": "2022-09-04T14:35:57.604659Z",
"structure_string": "Be1 V1 Si4\n1.0\n-0.000000 3.409306 3.409306\n3.409306 0.000000 3.409306\n3.409306 3.409306 -0.000000\nBe V Si\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 V\n0.126601 0.624467 0.624467 Si\n0.624467 0.624467 0.624467 Si\n0.624467 0.126601 0.624467 Si\n0.624467 0.624467 0.126601 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"V",
"Si"
],
"chemical_system": "Be-Si-V",
"density": 3.6099031211005337,
"density_atomic": 0.07570478080609146,
"volume": 79.25523244520404,
"volume_molar": 7.954769429192295,
"formula_full": "Be1 V1 Si4",
"formula_reduced": "BeVSi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.5560707833333334,
"spacegroup": 216
},
{
"id": "jvasp-79648",
"created_at": "2022-09-04T14:37:18.099550Z",
"updated_at": "2022-09-04T14:37:18.099571Z",
"structure_string": "Yb1 Co1 C2\n1.0\n-3.702192 0.000000 0.000000\n0.000000 -2.240761 -2.907579\n0.000000 -2.240761 2.907579\nYb Co C\n1 1 2\ndirect\n0.000000 0.002507 0.997492 Yb\n0.500000 0.380350 0.619649 Co\n0.500000 0.851816 0.449675 C\n0.500000 0.550325 0.148183 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Co",
"C"
],
"chemical_system": "C-Co-Yb",
"density": 8.811785138872427,
"density_atomic": 0.08291707951334569,
"volume": 48.24096583570808,
"volume_molar": 7.262847166524628,
"formula_full": "Yb1 Co1 C2",
"formula_reduced": "YbCoC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5562029000000006,
"spacegroup": 38
},
{
"id": "jvasp-69857",
"created_at": "2022-09-04T14:36:06.805219Z",
"updated_at": "2022-09-04T14:36:06.805245Z",
"structure_string": "Ta1 Be1 Si1\n1.0\n1.423251 -2.465143 -0.000000\n1.423251 2.465143 0.000000\n0.000000 -0.000000 6.206877\nTa Be Si\n1 1 1\ndirect\n0.333333 0.666667 0.671587 Ta\n-0.000000 0.000000 0.016535 Be\n0.666667 0.333333 0.311879 Si\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Si"
],
"chemical_system": "Be-Si-Ta",
"density": 8.313226233586988,
"density_atomic": 0.06888021673977432,
"volume": 43.55386992079069,
"volume_molar": 8.742917843524385,
"formula_full": "Ta1 Be1 Si1",
"formula_reduced": "TaBeSi",
"formula_anonymous": "ABC",
"energy_above_hull": 3.5564913,
"spacegroup": 156
},
{
"id": "jvasp-37177",
"created_at": "2022-09-04T14:38:02.277825Z",
"updated_at": "2022-09-04T14:38:02.277851Z",
"structure_string": "Mo2 N2\n1.0\n2.971785 0.000000 0.000000\n-1.485893 2.573139 0.000000\n-0.000000 -0.000000 6.241435\nMo N\n2 2\ndirect\n0.666681 0.333359 0.528433 Mo\n0.333322 0.666642 0.028434 Mo\n0.666735 0.333468 0.846366 N\n0.333268 0.666533 0.346366 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mo",
"N"
],
"chemical_system": "Mo-N",
"density": 7.650612510616261,
"density_atomic": 0.08380981958543547,
"volume": 47.72710429142987,
"volume_molar": 7.185483502754768,
"formula_full": "Mo2 N2",
"formula_reduced": "MoN",
"formula_anonymous": "AB",
"energy_above_hull": 3.5565645750000003,
"spacegroup": 186
},
{
"id": "jvasp-42280",
"created_at": "2022-09-04T14:38:08.193780Z",
"updated_at": "2022-09-04T14:38:08.193805Z",
"structure_string": "Na2 Cr7 O14\n1.0\n5.658196 0.000057 0.000233\n2.828913 4.900526 0.001976\n2.826218 1.621481 9.176039\nNa Cr O\n2 7 14\ndirect\n0.304868 0.305067 0.085310 Na\n0.695149 0.694940 0.914681 Na\n-0.000008 0.500000 0.500003 Cr\n0.060181 0.060922 0.818993 Cr\n0.499994 -0.000001 0.500002 Cr\n-0.000006 -0.000001 0.500002 Cr\n0.574982 0.574518 0.275326 Cr\n0.425008 0.425484 0.724672 Cr\n0.939810 0.939078 0.181007 Cr\n0.632333 0.122357 0.613068 O\n0.219714 0.220535 0.858049 O\n0.780271 0.297080 0.142070 O\n0.297954 0.779386 0.141985 O\n0.122098 0.632579 0.613065 O\n0.877886 0.367423 0.386937 O\n0.367656 0.877642 0.386933 O\n0.219708 0.702920 0.857931 O\n0.780282 0.779459 0.141952 O\n0.367649 0.367413 0.386940 O\n0.632338 0.632590 0.613060 O\n0.127476 0.127758 0.617390 O\n0.702036 0.220618 0.858015 O\n0.872512 0.872243 0.382611 O\n",
"nsites": 23,
"nelements": 3,
"elements": [
"Na",
"Cr",
"O"
],
"chemical_system": "Cr-Na-O",
"density": 4.137720033042105,
"density_atomic": 0.09040429325447183,
"volume": 254.41269625612952,
"volume_molar": 6.66134377385016,
"formula_full": "Na2 Cr7 O14",
"formula_reduced": "Na2Cr7O14",
"formula_anonymous": "A2B7C14",
"energy_above_hull": 3.5569612521739136,
"spacegroup": 166
},
{
"id": "jvasp-48315",
"created_at": "2022-09-04T14:36:05.843622Z",
"updated_at": "2022-09-04T14:36:05.843651Z",
"structure_string": "Fe8 O9\n1.0\n5.210430 0.032209 -0.016197\n0.875558 5.140936 -0.015582\n1.755237 0.627726 6.455747\nFe O\n8 9\ndirect\n0.896286 0.786688 0.424177 Fe\n0.441701 0.897235 0.205723 Fe\n0.795038 0.549126 0.892206 Fe\n0.322716 0.681642 0.674351 Fe\n0.204963 0.450876 0.107795 Fe\n0.677285 0.318360 0.325649 Fe\n0.558299 0.102767 0.794277 Fe\n0.103714 0.213314 0.575823 Fe\n0.065083 0.120351 0.290258 O\n0.596980 0.235893 0.058460 O\n0.279068 0.555768 0.390785 O\n0.817720 0.660981 0.172789 O\n0.720933 0.444234 0.609215 O\n0.934917 0.879651 0.709742 O\n0.182280 0.339021 0.827211 O\n0.403020 0.764109 0.941541 O\n0.500000 0.000001 0.500000 O\n",
"nsites": 17,
"nelements": 2,
"elements": [
"Fe",
"O"
],
"chemical_system": "Fe-O",
"density": 5.672580763833398,
"density_atomic": 0.0983045002695421,
"volume": 172.93206265621134,
"volume_molar": 6.126007195487319,
"formula_full": "Fe8 O9",
"formula_reduced": "Fe8O9",
"formula_anonymous": "A8B9",
"energy_above_hull": 3.5570391470588234,
"spacegroup": 2
},
{
"id": "jvasp-16542",
"created_at": "2022-09-04T14:37:42.307347Z",
"updated_at": "2022-09-04T14:37:42.307374Z",
"structure_string": "Hf2 Pd1\n1.0\n3.153145 -0.000000 -0.889149\n-0.250729 3.143161 -0.889149\n-0.045528 -0.049305 5.874044\nHf Pd\n2 1\ndirect\n0.658392 0.658392 0.316781 Hf\n0.341609 0.341610 0.683218 Hf\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hf",
"Pd"
],
"chemical_system": "Hf-Pd",
"density": 13.280813476683294,
"density_atomic": 0.05177746753875536,
"volume": 57.940261326116506,
"volume_molar": 11.630813645901931,
"formula_full": "Hf2 Pd1",
"formula_reduced": "Hf2Pd",
"formula_anonymous": "AB2",
"energy_above_hull": 3.557197233333334,
"spacegroup": 139
}
]
}