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=-volume&page=4141",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=4139",
"results": [
{
"id": "jvasp-118249",
"created_at": "2022-09-04T14:38:48.264682Z",
"updated_at": "2022-09-04T14:38:48.264698Z",
"structure_string": "Mn1 In1 F1\n1.0\n4.659961 0.000000 -0.000000\n-2.329981 4.035645 0.000000\n0.000000 -0.000000 2.897521\nMn In F\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Mn\n0.333332 0.666665 0.000000 In\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mn",
"In",
"F"
],
"chemical_system": "F-In-Mn",
"density": 5.7520739685399045,
"density_atomic": 0.0550553368825719,
"volume": 54.49063015269039,
"volume_molar": 10.93834149602006,
"formula_full": "Mn1 In1 F1",
"formula_reduced": "MnInF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.9859791646264364,
"spacegroup": 187
},
{
"id": "jvasp-67518",
"created_at": "2022-09-04T14:35:56.760946Z",
"updated_at": "2022-09-04T14:35:56.760965Z",
"structure_string": "Be2 Nb1 Se1\n1.0\n3.210210 0.000000 0.000000\n0.000000 3.210210 0.000000\n0.000000 0.000000 5.287393\nBe Nb Se\n2 1 1\ndirect\n0.000000 0.000000 0.028341 Be\n0.500000 0.500000 0.205094 Be\n0.000000 0.000000 0.493455 Nb\n0.500000 0.500000 0.773110 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Nb",
"Se"
],
"chemical_system": "Be-Nb-Se",
"density": 5.786879181877725,
"density_atomic": 0.07340937272103061,
"volume": 54.48895490771663,
"volume_molar": 8.20350390798906,
"formula_full": "Be2 Nb1 Se1",
"formula_reduced": "Be2NbSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6420837416666663,
"spacegroup": 99
},
{
"id": "jvasp-22556",
"created_at": "2022-09-04T14:35:40.865649Z",
"updated_at": "2022-09-04T14:35:40.865684Z",
"structure_string": "Sr1 Fe1 O3\n1.0\n3.790914 -0.000000 0.000000\n0.000000 3.790914 0.000000\n-0.000000 -0.000000 3.790914\nSr Fe O\n1 1 3\ndirect\n0.499998 0.499998 0.499998 Sr\n0.000000 0.000000 0.000000 Fe\n0.499998 0.000000 0.000000 O\n0.000000 0.499998 0.000000 O\n0.000000 0.000000 0.499998 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Fe",
"O"
],
"chemical_system": "Fe-O-Sr",
"density": 5.835829754988773,
"density_atomic": 0.09177791932884174,
"volume": 54.47933486141607,
"volume_molar": 6.561644460932454,
"formula_full": "Sr1 Fe1 O3",
"formula_reduced": "SrFeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7365824619999997,
"spacegroup": 221
},
{
"id": "jvasp-71864",
"created_at": "2022-09-04T14:36:19.190978Z",
"updated_at": "2022-09-04T14:36:19.191004Z",
"structure_string": "Be1 Ga2 W1\n1.0\n3.623081 0.000000 0.000000\n0.000000 3.623081 -0.000000\n-0.000000 -0.000000 4.150225\nBe Ga W\n1 2 1\ndirect\n0.000000 0.000000 0.499999 Be\n0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 0.000000 Ga\n0.500000 0.500000 0.499999 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ga",
"W"
],
"chemical_system": "Be-Ga-W",
"density": 10.128597977405944,
"density_atomic": 0.07342302311177706,
"volume": 54.47882463121297,
"volume_molar": 8.20197875921299,
"formula_full": "Be1 Ga2 W1",
"formula_reduced": "BeGa2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.2758326875,
"spacegroup": 123
},
{
"id": "jvasp-71857",
"created_at": "2022-09-04T14:36:16.564703Z",
"updated_at": "2022-09-04T14:36:16.564739Z",
"structure_string": "Hf1 Be2 W1\n1.0\n2.763988 -0.000000 -0.000000\n-0.000000 2.763988 0.000000\n0.000000 -0.000000 7.130998\nHf Be W\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Hf\n0.000000 0.000000 0.733478 Be\n0.000000 0.000000 0.266523 Be\n0.500000 0.500000 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"W"
],
"chemical_system": "Be-Hf-W",
"density": 11.593508371096629,
"density_atomic": 0.07342388671750298,
"volume": 54.47818385575153,
"volume_molar": 8.201882288212381,
"formula_full": "Hf1 Be2 W1",
"formula_reduced": "HfBe2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.2949188000000005,
"spacegroup": 123
},
{
"id": "jvasp-100006",
"created_at": "2022-09-04T14:36:32.192845Z",
"updated_at": "2022-09-04T14:36:32.192881Z",
"structure_string": "Cu3 Ge1\n1.0\n2.747934 0.000000 0.000000\n-1.373967 2.379780 -0.000000\n-0.000000 -0.000000 8.330493\nCu Ge\n3 1\ndirect\n0.333332 0.666667 0.500000 Cu\n0.000000 0.000000 0.739609 Cu\n0.000000 0.000000 0.260391 Cu\n0.333332 0.666667 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Ge"
],
"chemical_system": "Cu-Ge",
"density": 8.025088969987614,
"density_atomic": 0.07342537607470434,
"volume": 54.47707882259024,
"volume_molar": 8.201715921581338,
"formula_full": "Cu3 Ge1",
"formula_reduced": "Cu3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0372975,
"spacegroup": 187
},
{
"id": "jvasp-70414",
"created_at": "2022-09-04T14:36:08.613090Z",
"updated_at": "2022-09-04T14:36:08.613111Z",
"structure_string": "Be2 In1 W1\n1.0\n-1.761705 1.761705 4.388190\n1.761705 -1.761705 4.388190\n1.761705 1.761705 -4.388190\nBe In W\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.500000 0.500000 0.000000 In\n0.750001 0.250000 0.500001 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"In",
"W"
],
"chemical_system": "Be-In-W",
"density": 9.652975126105016,
"density_atomic": 0.07342571812085144,
"volume": 54.47682504672814,
"volume_molar": 8.201677714732261,
"formula_full": "Be2 In1 W1",
"formula_reduced": "Be2InW",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.8600855425,
"spacegroup": 119
},
{
"id": "jvasp-37981",
"created_at": "2022-09-04T14:38:17.885253Z",
"updated_at": "2022-09-04T14:38:17.885270Z",
"structure_string": "Co1 Te1 O3\n1.0\n3.790715 -0.000000 -0.000000\n-0.000000 3.790715 -0.000000\n-0.000000 0.000000 3.790715\nCo Te O\n1 1 3\ndirect\n0.499999 0.499999 0.499999 Co\n0.000000 0.000000 0.000000 Te\n0.499999 0.499999 0.000000 O\n0.000000 0.499999 0.499999 O\n0.499999 0.000000 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Co",
"Te",
"O"
],
"chemical_system": "Co-O-Te",
"density": 7.149681291701809,
"density_atomic": 0.09179237419929702,
"volume": 54.470755807493774,
"volume_molar": 6.560611175526299,
"formula_full": "Co1 Te1 O3",
"formula_reduced": "CoTeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.3150118333333336,
"spacegroup": 221
},
{
"id": "jvasp-111028",
"created_at": "2022-09-04T14:38:36.809779Z",
"updated_at": "2022-09-04T14:38:36.809798Z",
"structure_string": "Mn1 Ni2 Sb1\n1.0\n3.684749 -0.000000 2.127391\n1.228250 3.474015 2.127391\n-0.000000 -0.000000 4.254782\nMn Ni Sb\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Mn\n0.500000 0.499999 0.500000 Ni\n0.750001 0.749999 0.750000 Ni\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Ni",
"Sb"
],
"chemical_system": "Mn-Ni-Sb",
"density": 8.966125840127424,
"density_atomic": 0.07344176052292695,
"volume": 54.464925289356124,
"volume_molar": 8.199886164384656,
"formula_full": "Mn1 Ni2 Sb1",
"formula_reduced": "MnNi2Sb",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9908195353448277,
"spacegroup": 216
},
{
"id": "jvasp-110808",
"created_at": "2022-09-04T14:38:37.257317Z",
"updated_at": "2022-09-04T14:38:37.257337Z",
"structure_string": "Li2 Ge1 Pt1\n1.0\n3.684609 -0.000000 2.127310\n1.228203 3.473883 2.127310\n0.000000 -0.000000 4.254621\nLi Ge Pt\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.749999 0.750000 Li\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ge",
"Pt"
],
"chemical_system": "Ge-Li-Pt",
"density": 8.586645353079769,
"density_atomic": 0.07345012107741475,
"volume": 54.45872574919368,
"volume_molar": 8.19895280179702,
"formula_full": "Li2 Ge1 Pt1",
"formula_reduced": "Li2GePt",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0712818375,
"spacegroup": 225
},
{
"id": "jvasp-92338",
"created_at": "2022-09-04T14:36:20.374819Z",
"updated_at": "2022-09-04T14:36:20.374835Z",
"structure_string": "Ca1 Cu1 O3\n1.0\n3.790435 -0.000000 -0.000000\n0.000000 3.790435 0.000000\n0.000000 0.000000 3.790435\nCa Cu O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Ca\n0.000000 0.000000 0.000000 Cu\n0.500001 0.000000 0.000000 O\n0.000000 0.500001 0.000000 O\n0.000000 0.000000 0.500001 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Cu",
"O"
],
"chemical_system": "Ca-Cu-O",
"density": 4.623221813822303,
"density_atomic": 0.09181271785121808,
"volume": 54.45868630207057,
"volume_molar": 6.559157490315058,
"formula_full": "Ca1 Cu1 O3",
"formula_reduced": "CaCuO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.054364274,
"spacegroup": 221
},
{
"id": "jvasp-39408",
"created_at": "2022-09-04T14:35:53.567659Z",
"updated_at": "2022-09-04T14:35:53.567686Z",
"structure_string": "Li1 Fe1 Pd2\n1.0\n-0.000003 3.008448 3.008445\n3.008445 0.000009 3.008432\n3.008448 3.008437 0.000007\nLi Fe Pd\n1 1 2\ndirect\n0.749998 0.750006 0.749998 Li\n0.250000 0.249996 0.250012 Fe\n0.000000 0.000000 0.999996 Pd\n0.500000 0.499998 0.500001 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Fe",
"Pd"
],
"chemical_system": "Fe-Li-Pd",
"density": 8.404561834572492,
"density_atomic": 0.07345236575854283,
"volume": 54.457061507713014,
"volume_molar": 8.198702244385641,
"formula_full": "Li1 Fe1 Pd2",
"formula_reduced": "LiFePd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.803991725,
"spacegroup": 225
}
]
}