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=3399",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=3397",
"results": [
{
"id": "jvasp-91615",
"created_at": "2022-09-04T14:36:07.392368Z",
"updated_at": "2022-09-04T14:36:07.392398Z",
"structure_string": "Dy4 Pt4\n1.0\n0.000000 4.498892 0.000000\n0.000000 -0.000000 5.563415\n7.022568 0.000000 0.000000\nDy Pt\n4 4\ndirect\n0.250000 0.357172 0.682525 Dy\n0.250000 0.142828 0.182524 Dy\n0.750000 0.642829 0.317476 Dy\n0.750000 0.857173 0.817476 Dy\n0.250000 0.840845 0.545028 Pt\n0.250000 0.659156 0.045028 Pt\n0.750000 0.159156 0.454972 Pt\n0.750000 0.340845 0.954972 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Dy",
"Pt"
],
"chemical_system": "Dy-Pt",
"density": 13.512763909779663,
"density_atomic": 0.04551421000350284,
"volume": 175.7692817118941,
"volume_molar": 13.231341946914002,
"formula_full": "Dy4 Pt4",
"formula_reduced": "DyPt",
"formula_anonymous": "AB",
"energy_above_hull": 0.65967895,
"spacegroup": 62
},
{
"id": "jvasp-100310",
"created_at": "2022-09-04T14:36:31.412809Z",
"updated_at": "2022-09-04T14:36:31.412829Z",
"structure_string": "Ag3 Sb1 Te4\n1.0\n5.991922 0.000000 0.000000\n-0.000000 5.991922 0.000000\n-0.000000 -0.000000 5.991922\nAg Sb Te\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n0.500000 0.500000 0.500000 Sb\n0.500000 0.000000 0.000000 Te\n0.000000 0.500000 0.000000 Te\n0.000000 0.000000 0.500000 Te\n0.000000 0.000000 0.000000 Te\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ag",
"Sb",
"Te"
],
"chemical_system": "Ag-Sb-Te",
"density": 7.377370325589163,
"density_atomic": 0.037187033338291195,
"volume": 215.1287500463895,
"volume_molar": 16.19419517877768,
"formula_full": "Ag3 Sb1 Te4",
"formula_reduced": "Ag3SbTe4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.6596686183333335,
"spacegroup": 221
},
{
"id": "jvasp-19891",
"created_at": "2022-09-04T14:36:30.883678Z",
"updated_at": "2022-09-04T14:36:30.883688Z",
"structure_string": "Y1 Cd1\n1.0\n3.725211 0.000000 -0.000000\n-0.000000 3.725211 -0.000000\n-0.000000 0.000000 3.725211\nY Cd\n1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Cd"
],
"chemical_system": "Cd-Y",
"density": 6.466608872081365,
"density_atomic": 0.038688096779774396,
"volume": 51.69548689315656,
"volume_molar": 15.565874936366194,
"formula_full": "Y1 Cd1",
"formula_reduced": "YCd",
"formula_anonymous": "AB",
"energy_above_hull": 0.6596468166666667,
"spacegroup": 221
},
{
"id": "jvasp-17505",
"created_at": "2022-09-04T14:38:29.705122Z",
"updated_at": "2022-09-04T14:38:29.705149Z",
"structure_string": "Yb3 In1 C1\n1.0\n4.987647 0.000000 0.000000\n0.000000 4.987647 0.000000\n-0.000000 -0.000000 4.987647\nYb In C\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Yb\n0.500000 0.500000 0.000000 Yb\n0.000000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Yb",
"In",
"C"
],
"chemical_system": "C-In-Yb",
"density": 8.644900513044934,
"density_atomic": 0.04029794298196119,
"volume": 124.07581206410909,
"volume_molar": 14.94404010322742,
"formula_full": "Yb3 In1 C1",
"formula_reduced": "Yb3InC",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.6596324140000003,
"spacegroup": 221
},
{
"id": "jvasp-22704",
"created_at": "2022-09-04T14:35:54.943352Z",
"updated_at": "2022-09-04T14:35:54.943372Z",
"structure_string": "Ca3 Cd1 O4\n1.0\n0.000000 2.405916 2.405916\n-4.793521 2.384990 -2.384990\n-4.793521 -2.384990 2.384990\nCa Cd O\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Ca\n0.500001 -0.000000 0.500000 Ca\n0.500001 0.500000 -0.000000 Ca\n0.000000 0.000000 0.000000 Cd\n0.000000 0.746299 0.746299 O\n0.500001 0.253961 0.746039 O\n0.500001 0.746039 0.253961 O\n0.000000 0.253701 0.253701 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ca",
"Cd",
"O"
],
"chemical_system": "Ca-Cd-O",
"density": 4.477143021029655,
"density_atomic": 0.07271237640071847,
"volume": 110.02253530969664,
"volume_molar": 8.282139930088292,
"formula_full": "Ca3 Cd1 O4",
"formula_reduced": "Ca3CdO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.6596076675000002,
"spacegroup": 65
},
{
"id": "jvasp-90789",
"created_at": "2022-09-04T14:36:04.895887Z",
"updated_at": "2022-09-04T14:36:04.895917Z",
"structure_string": "Mg3 Ga1 O4\n1.0\n4.344240 0.000000 0.000000\n0.000000 4.344240 0.000000\n-0.000000 -0.000000 4.344240\nMg Ga O\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Ga\n0.500000 0.000000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Ga",
"O"
],
"chemical_system": "Ga-Mg-O",
"density": 4.185167198042181,
"density_atomic": 0.09757724604842402,
"volume": 81.98632697657702,
"volume_molar": 6.171665018104151,
"formula_full": "Mg3 Ga1 O4",
"formula_reduced": "Mg3GaO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.6594779343749999,
"spacegroup": 221
},
{
"id": "jvasp-109318",
"created_at": "2022-09-04T14:38:09.515259Z",
"updated_at": "2022-09-04T14:38:09.515279Z",
"structure_string": "Y2 Mg4\n1.0\n5.191783 -0.000000 2.997477\n1.730594 4.894860 2.997477\n-0.000000 -0.000000 5.994954\nY Mg\n2 4\ndirect\n0.250000 0.250000 0.250000 Y\n0.000000 0.000000 0.000000 Y\n0.625000 0.125000 0.625000 Mg\n0.624999 0.625000 0.625001 Mg\n0.124999 0.625000 0.625000 Mg\n0.624999 0.625000 0.125001 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 2.9977070462438453,
"density_atomic": 0.0393829812257195,
"volume": 152.35007135726008,
"volume_molar": 15.291226241824408,
"formula_full": "Y2 Mg4",
"formula_reduced": "YMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6593317738095237,
"spacegroup": 227
},
{
"id": "jvasp-14231",
"created_at": "2022-09-04T14:37:07.351690Z",
"updated_at": "2022-09-04T14:37:07.351720Z",
"structure_string": "Rb6 Mo4 Br18\n1.0\n3.730938 -6.462175 -0.000000\n3.730938 6.462175 0.000000\n-0.000000 0.000000 18.103093\nRb Mo Br\n6 4 18\ndirect\n0.000000 0.000000 0.750000 Rb\n0.000000 0.000000 0.250000 Rb\n0.333333 0.666667 0.930835 Rb\n0.666667 0.333333 0.430835 Rb\n0.333333 0.666667 0.569165 Rb\n0.666667 0.333333 0.069165 Rb\n0.333333 0.666667 0.328299 Mo\n0.666667 0.333333 0.828299 Mo\n0.333333 0.666667 0.171701 Mo\n0.666667 0.333333 0.671701 Mo\n0.170852 0.341704 0.409828 Br\n-0.009108 0.495446 0.250000 Br\n0.495446 0.504554 0.750000 Br\n0.495446 -0.009108 0.750000 Br\n0.504554 0.009108 0.250000 Br\n0.504554 0.495446 0.250000 Br\n0.009108 0.504554 0.750000 Br\n0.829149 0.658297 0.909828 Br\n0.170852 0.341704 0.090171 Br\n0.658297 0.829149 0.090171 Br\n0.170852 0.829149 0.090171 Br\n0.658297 0.829149 0.409828 Br\n0.341704 0.170852 0.909828 Br\n0.829149 0.658297 0.590171 Br\n0.341704 0.170852 0.590171 Br\n0.829149 0.170852 0.590171 Br\n0.829149 0.170852 0.909828 Br\n0.170852 0.829149 0.409828 Br\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Rb",
"Mo",
"Br"
],
"chemical_system": "Br-Mo-Rb",
"density": 4.441467352608704,
"density_atomic": 0.03207587455085668,
"volume": 872.9302128802652,
"volume_molar": 18.774673627220434,
"formula_full": "Rb6 Mo4 Br18",
"formula_reduced": "Rb3Mo2Br9",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 0.6592991960714281,
"spacegroup": 194
},
{
"id": "jvasp-114969",
"created_at": "2022-09-04T14:38:43.518678Z",
"updated_at": "2022-09-04T14:38:43.518697Z",
"structure_string": "In1 Ga1 O2\n1.0\n1.662590 0.959897 6.656618\n-1.662590 0.959897 6.656618\n-0.000000 -1.919793 6.656618\nIn Ga O\n1 1 2\ndirect\n0.000241 0.000241 0.000241 In\n0.825999 0.825999 0.825994 Ga\n0.729635 0.729635 0.729631 O\n0.285128 0.285128 0.285127 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"In",
"Ga",
"O"
],
"chemical_system": "Ga-In-O",
"density": 5.6412103729607495,
"density_atomic": 0.0627545844865134,
"volume": 63.740363078328414,
"volume_molar": 9.596335963780016,
"formula_full": "In1 Ga1 O2",
"formula_reduced": "InGaO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6592973237499999,
"spacegroup": 160
},
{
"id": "jvasp-39208",
"created_at": "2022-09-04T14:37:48.689584Z",
"updated_at": "2022-09-04T14:37:48.689597Z",
"structure_string": "Ho1 Lu1 Au2\n1.0\n0.000008 3.534127 3.534149\n3.534136 0.000021 3.534136\n3.534163 3.534141 -0.000006\nHo Lu Au\n1 1 2\ndirect\n0.249998 0.250002 0.250001 Ho\n0.750003 0.749997 0.750002 Lu\n0.499998 0.500002 0.499999 Au\n-0.000000 -0.000001 0.999998 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Lu",
"Au"
],
"chemical_system": "Au-Ho-Lu",
"density": 13.802706798463838,
"density_atomic": 0.04530847273067715,
"volume": 88.28370851908471,
"volume_molar": 13.291422987918482,
"formula_full": "Ho1 Lu1 Au2",
"formula_reduced": "HoLuAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6592691141666667,
"spacegroup": 225
},
{
"id": "jvasp-37159",
"created_at": "2022-09-04T14:38:04.197168Z",
"updated_at": "2022-09-04T14:38:04.197194Z",
"structure_string": "Na1 Sm1 S2\n1.0\n-2.029166 -3.514619 -0.000000\n-4.058333 -0.000000 -0.000000\n-2.029166 -1.171539 -6.613009\nNa Sm S\n1 1 2\ndirect\n0.500000 0.500001 0.500000 Na\n0.000000 0.000000 0.000000 Sm\n0.744784 0.744785 0.765647 S\n0.255216 0.255216 0.234353 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Sm",
"S"
],
"chemical_system": "Na-S-Sm",
"density": 4.180716033882948,
"density_atomic": 0.04240674566707686,
"volume": 94.3246159797983,
"volume_molar": 14.200902864082266,
"formula_full": "Na1 Sm1 S2",
"formula_reduced": "NaSmS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6589669687499999,
"spacegroup": 166
},
{
"id": "jvasp-39250",
"created_at": "2022-09-04T14:37:56.013059Z",
"updated_at": "2022-09-04T14:37:56.013086Z",
"structure_string": "Hg3 C1\n1.0\n-2.164298 2.164298 4.220648\n2.164298 -2.164298 4.220648\n2.164298 2.164298 -4.220648\nHg C\n3 1\ndirect\n0.750001 0.250000 0.500001 Hg\n0.250000 0.750001 0.500001 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Hg",
"C"
],
"chemical_system": "C-Hg",
"density": 12.888105554858747,
"density_atomic": 0.05058092299605967,
"volume": 79.08119826741014,
"volume_molar": 11.9059526858953,
"formula_full": "Hg3 C1",
"formula_reduced": "Hg3C",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6589434499999999,
"spacegroup": 139
}
]
}