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=3567",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=3565",
"results": [
{
"id": "jvasp-118050",
"created_at": "2022-09-04T14:38:53.835525Z",
"updated_at": "2022-09-04T14:38:53.835543Z",
"structure_string": "H1 Pd1 Cl2\n1.0\n3.888851 0.000000 -0.000000\n0.000000 3.888851 0.000000\n-0.000000 0.000000 4.851023\nH Pd Cl\n1 1 2\ndirect\n0.500000 0.500000 0.666801 H\n0.000000 0.000000 0.952458 Pd\n0.000000 0.000000 0.453571 Cl\n0.500000 0.500000 0.937168 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"H",
"Pd",
"Cl"
],
"chemical_system": "Cl-H-Pd",
"density": 4.036520488384312,
"density_atomic": 0.05452354065653406,
"volume": 73.36280718080334,
"volume_molar": 11.045028784788414,
"formula_full": "H1 Pd1 Cl2",
"formula_reduced": "HPdCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0766734587500002,
"spacegroup": 99
},
{
"id": "jvasp-54998",
"created_at": "2022-09-04T14:37:29.804795Z",
"updated_at": "2022-09-04T14:37:29.804825Z",
"structure_string": "Np1 Si2 Ni2\n1.0\n3.658415 0.000000 -1.404295\n-0.539043 3.618486 -1.404295\n0.021146 0.024530 5.522618\nNp Si Ni\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Np\n0.377750 0.377749 0.755495 Si\n0.622254 0.622253 0.244504 Si\n0.750002 0.250000 0.500000 Ni\n0.250002 0.750001 0.500000 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Np",
"Si",
"Ni"
],
"chemical_system": "Ni-Np-Si",
"density": 9.293169545999378,
"density_atomic": 0.06815699900463928,
"volume": 73.36003745792361,
"volume_molar": 8.835689434609773,
"formula_full": "Np1 Si2 Ni2",
"formula_reduced": "Np(SiNi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.2089343999999995,
"spacegroup": 139
},
{
"id": "jvasp-65174",
"created_at": "2022-09-04T14:35:42.586884Z",
"updated_at": "2022-09-04T14:35:42.586918Z",
"structure_string": "Li4 Mn1 Be1\n1.0\n-0.000000 3.322480 3.322480\n3.322480 -0.000000 3.322480\n3.322480 3.322480 -0.000000\nLi Mn Be\n4 1 1\ndirect\n0.125093 0.624969 0.624969 Li\n0.624969 0.624969 0.624969 Li\n0.624969 0.125093 0.624969 Li\n0.624969 0.624969 0.125093 Li\n0.250000 0.250000 0.250000 Mn\n0.000000 0.000000 0.000000 Be\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Mn",
"Be"
],
"chemical_system": "Be-Li-Mn",
"density": 2.076197605328343,
"density_atomic": 0.08179638844374514,
"volume": 73.35287185847399,
"volume_molar": 7.362355324699553,
"formula_full": "Li4 Mn1 Be1",
"formula_reduced": "Li4MnBe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.746235556896552,
"spacegroup": 216
},
{
"id": "jvasp-837",
"created_at": "2022-09-04T14:37:48.422719Z",
"updated_at": "2022-09-04T14:37:48.422732Z",
"structure_string": "Bi2\n1.0\n4.043929 0.013912 2.626676\n1.433104 3.781504 2.626676\n0.020077 0.013912 4.822073\nBi\n2\ndirect\n0.234564 0.234563 0.234564 Bi\n0.765437 0.765435 0.765437 Bi\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Bi"
],
"chemical_system": "Bi",
"density": 9.462092223215686,
"density_atomic": 0.02726669643277455,
"volume": 73.34955317858021,
"volume_molar": 22.08606669622577,
"formula_full": "Bi2",
"formula_reduced": "Bi",
"formula_anonymous": "A",
"energy_above_hull": 4.300000000068138e-06,
"spacegroup": 166
},
{
"id": "jvasp-18338",
"created_at": "2022-09-04T14:38:08.306968Z",
"updated_at": "2022-09-04T14:38:08.306994Z",
"structure_string": "Bi2\n1.0\n4.043753 0.013538 2.625922\n1.432692 3.781470 2.625922\n0.019537 0.013538 4.821516\nBi\n2\ndirect\n0.234567 0.234567 0.234567 Bi\n0.765432 0.765434 0.765433 Bi\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Bi"
],
"chemical_system": "Bi",
"density": 9.462324714018228,
"density_atomic": 0.027267366396244233,
"volume": 73.34775096855255,
"volume_molar": 22.085524038102488,
"formula_full": "Bi2",
"formula_reduced": "Bi",
"formula_anonymous": "A",
"energy_above_hull": 4.300000000068138e-06,
"spacegroup": 166
},
{
"id": "jvasp-17561",
"created_at": "2022-09-04T14:38:29.927565Z",
"updated_at": "2022-09-04T14:38:29.927597Z",
"structure_string": "Y1 In1 Cu2\n1.0\n4.069036 0.000000 2.349259\n1.356346 3.836323 2.349259\n0.000000 0.000000 4.698517\nY In Cu\n1 1 2\ndirect\n0.500001 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 In\n0.250001 0.250000 0.250000 Cu\n0.750002 0.749999 0.750000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"In",
"Cu"
],
"chemical_system": "Cu-In-Y",
"density": 7.489760084491909,
"density_atomic": 0.05453715655163062,
"volume": 73.34449122247835,
"volume_molar": 11.042271252808728,
"formula_full": "Y1 In1 Cu2",
"formula_reduced": "YInCu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3016015799999999,
"spacegroup": 225
},
{
"id": "jvasp-111256",
"created_at": "2022-09-04T14:38:48.688517Z",
"updated_at": "2022-09-04T14:38:48.688544Z",
"structure_string": "Cd1 Ag3\n1.0\n4.185893 -0.000000 0.000000\n0.000000 4.185893 0.000000\n0.000000 -0.000000 4.185893\nCd Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n-0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 -0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd",
"density": 9.871581998993937,
"density_atomic": 0.05453754988800185,
"volume": 73.34396224645933,
"volume_molar": 11.042191613607597,
"formula_full": "Cd1 Ag3",
"formula_reduced": "CdAg3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-39397",
"created_at": "2022-09-04T14:37:51.275555Z",
"updated_at": "2022-09-04T14:37:51.275585Z",
"structure_string": "K1 Sc1 O3\n1.0\n4.185846 -0.000000 -0.000000\n0.000000 4.185846 -0.000000\n0.000000 -0.000000 4.185846\nK Sc O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Sc\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Sc",
"O"
],
"chemical_system": "K-O-Sc",
"density": 2.9898245023218726,
"density_atomic": 0.06817423375387288,
"volume": 73.34149171446987,
"volume_molar": 8.833455733058226,
"formula_full": "K1 Sc1 O3",
"formula_reduced": "KScO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.4631107499999998,
"spacegroup": 221
},
{
"id": "jvasp-25687",
"created_at": "2022-09-04T14:37:46.143578Z",
"updated_at": "2022-09-04T14:37:46.143593Z",
"structure_string": "Fe2 F4\n1.0\n4.889794 -0.000000 0.000000\n-0.000000 4.889794 0.000000\n0.000000 0.000000 3.067119\nFe F\n2 4\ndirect\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.706086 0.706086 0.000000 F\n0.206087 0.793912 0.500000 F\n0.293913 0.293913 0.000000 F\n0.793912 0.206087 0.500000 F\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"F"
],
"chemical_system": "F-Fe",
"density": 4.249753099207482,
"density_atomic": 0.08181623633211935,
"volume": 73.33507710674935,
"volume_molar": 7.360569283038302,
"formula_full": "Fe2 F4",
"formula_reduced": "FeF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.2576786883333333,
"spacegroup": 136
},
{
"id": "jvasp-117690",
"created_at": "2022-09-04T14:38:53.571823Z",
"updated_at": "2022-09-04T14:38:53.571841Z",
"structure_string": "Li1 Be1 Te1\n1.0\n4.578269 0.000000 0.000000\n-2.289134 3.964897 -0.000000\n-0.000000 0.000000 4.039500\nLi Be Te\n1 1 1\ndirect\n0.333335 0.666666 0.000000 Li\n0.000000 0.000000 0.000000 Be\n0.666668 0.333333 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Be",
"Te"
],
"chemical_system": "Be-Li-Te",
"density": 3.250881150770869,
"density_atomic": 0.04091291523737546,
"volume": 73.32647851159209,
"volume_molar": 14.719412501064093,
"formula_full": "Li1 Be1 Te1",
"formula_reduced": "LiBeTe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.092574622222222,
"spacegroup": 187
},
{
"id": "jvasp-74753",
"created_at": "2022-09-04T14:35:45.648938Z",
"updated_at": "2022-09-04T14:35:45.648961Z",
"structure_string": "Sc1 Be1 Hg2\n1.0\n-2.350245 2.350245 3.318189\n2.350245 -2.350245 3.318189\n2.350245 2.350245 -3.318189\nSc Be Hg\n1 1 2\ndirect\n0.250000 0.750001 0.500001 Sc\n0.750001 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Hg"
],
"chemical_system": "Be-Hg-Sc",
"density": 10.308950170460436,
"density_atomic": 0.05455977942492971,
"volume": 73.31407938523118,
"volume_molar": 11.03769264369191,
"formula_full": "Sc1 Be1 Hg2",
"formula_reduced": "ScBeHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2878801374999998,
"spacegroup": 225
},
{
"id": "jvasp-16734",
"created_at": "2022-09-04T14:38:32.012450Z",
"updated_at": "2022-09-04T14:38:32.012466Z",
"structure_string": "Lu1 Si2 Ni2\n1.0\n3.675552 0.000000 -1.398025\n-0.531750 3.636884 -1.398025\n-0.013144 -0.015205 5.496160\nLu Si Ni\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Lu\n0.625139 0.625139 0.250278 Si\n0.374861 0.374861 0.749721 Si\n0.750000 0.250000 0.499999 Ni\n0.250000 0.750000 0.499999 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Lu",
"Si",
"Ni"
],
"chemical_system": "Lu-Ni-Si",
"density": 7.893981158074725,
"density_atomic": 0.06819983213123162,
"volume": 73.31396344757697,
"volume_molar": 8.830140151096067,
"formula_full": "Lu1 Si2 Ni2",
"formula_reduced": "Lu(SiNi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.90186955,
"spacegroup": 139
}
]
}