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=887",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=885",
"results": [
{
"id": "jvasp-35892",
"created_at": "2022-09-04T14:37:30.214281Z",
"updated_at": "2022-09-04T14:37:30.214305Z",
"structure_string": "Hf1 Ta1 N1 O3\n1.0\n3.525085 0.000000 0.000000\n0.000000 3.573251 0.000000\n0.000000 0.000000 5.257521\nHf Ta N O\n1 1 1 3\ndirect\n0.000000 0.000000 0.239738 Hf\n0.499999 0.500000 0.760309 Ta\n0.499999 0.000000 0.931369 N\n0.000000 0.500000 0.571138 O\n0.499999 0.000000 0.440579 O\n0.000000 0.500000 0.056867 O\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Hf",
"Ta",
"N",
"O"
],
"chemical_system": "Hf-N-O-Ta",
"density": 10.56753225290323,
"density_atomic": 0.09060186068649534,
"volume": 66.22380549955228,
"volume_molar": 6.646817973019433,
"formula_full": "Hf1 Ta1 N1 O3",
"formula_reduced": "HfTaNO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 4.076890991666667,
"spacegroup": 25
},
{
"id": "jvasp-118952",
"created_at": "2022-09-04T14:38:53.771343Z",
"updated_at": "2022-09-04T14:38:53.771361Z",
"structure_string": "Au2 S1\n1.0\n7.343665 0.000000 3.489007\n0.000000 2.830958 0.000000\n2.436924 0.000000 4.343430\nAu S\n2 1\ndirect\n-0.084644 0.000000 -0.095739 Au\n0.415192 0.000000 -0.095758 Au\n-0.084877 0.000000 0.404551 S\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Au",
"S"
],
"chemical_system": "Au-S",
"density": 10.681057323890137,
"density_atomic": 0.045297966085704286,
"volume": 66.22813912492151,
"volume_molar": 13.29450586943802,
"formula_full": "Au2 S1",
"formula_reduced": "Au2S",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8930217133333334,
"spacegroup": 65
},
{
"id": "jvasp-36619",
"created_at": "2022-09-04T14:37:29.645642Z",
"updated_at": "2022-09-04T14:37:29.645677Z",
"structure_string": "Cd1 Sn1 O3\n1.0\n4.046077 0.000000 0.000000\n-0.000000 4.046077 0.000000\n-0.000000 -0.000000 4.046077\nCd Sn O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Sn\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": [
"Cd",
"Sn",
"O"
],
"chemical_system": "Cd-O-Sn",
"density": 6.997394812726384,
"density_atomic": 0.07548620182720245,
"volume": 66.23727090476268,
"volume_molar": 7.977803378934668,
"formula_full": "Cd1 Sn1 O3",
"formula_reduced": "CdSnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.98052039,
"spacegroup": 221
},
{
"id": "jvasp-71109",
"created_at": "2022-09-04T14:35:58.143046Z",
"updated_at": "2022-09-04T14:35:58.143071Z",
"structure_string": "Be1 Re2 Bi1\n1.0\n3.143754 0.000000 0.000000\n-0.000000 3.143754 -0.000000\n-0.000000 0.000000 6.702308\nBe Re Bi\n1 2 1\ndirect\n0.000000 0.000000 0.413955 Be\n0.000000 0.000000 0.051802 Re\n0.499999 0.499999 0.287454 Re\n0.499999 0.499999 0.746789 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Re",
"Bi"
],
"chemical_system": "Be-Bi-Re",
"density": 14.800582099058072,
"density_atomic": 0.060386311046421094,
"volume": 66.24017812455969,
"volume_molar": 9.972691915839281,
"formula_full": "Be1 Re2 Bi1",
"formula_reduced": "BeRe2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.246806599999999,
"spacegroup": 99
},
{
"id": "jvasp-69893",
"created_at": "2022-09-04T14:36:18.457174Z",
"updated_at": "2022-09-04T14:36:18.457199Z",
"structure_string": "Be2 In1 Hg1\n1.0\n2.991161 0.000000 0.000000\n0.000000 2.991161 0.000000\n0.000000 0.000000 7.403586\nBe In Hg\n2 1 1\ndirect\n0.000000 0.000000 0.776719 Be\n0.000000 0.000000 0.223281 Be\n0.500000 0.500000 0.500000 In\n0.500000 0.500000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"In",
"Hg"
],
"chemical_system": "Be-Hg-In",
"density": 8.358630823844658,
"density_atomic": 0.060386281398242,
"volume": 66.24021064685812,
"volume_molar": 9.972696812185758,
"formula_full": "Be2 In1 Hg1",
"formula_reduced": "Be2InHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6087241124999999,
"spacegroup": 123
},
{
"id": "jvasp-74074",
"created_at": "2022-09-04T14:35:40.839929Z",
"updated_at": "2022-09-04T14:35:40.839956Z",
"structure_string": "Be1 Re2 Bi1\n1.0\n3.143762 0.000000 -0.000000\n0.000000 3.143762 0.000000\n-0.000000 -0.000000 6.702403\nBe Re Bi\n1 2 1\ndirect\n0.000000 0.000000 0.413959 Be\n0.000000 0.000000 0.051808 Re\n0.500000 0.500000 0.287441 Re\n0.500000 0.500000 0.746792 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Re",
"Bi"
],
"chemical_system": "Be-Bi-Re",
"density": 14.80029698973133,
"density_atomic": 0.06038514780159925,
"volume": 66.2414541592637,
"volume_molar": 9.972884027354336,
"formula_full": "Be1 Re2 Bi1",
"formula_reduced": "BeRe2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.246806599999999,
"spacegroup": 99
},
{
"id": "jvasp-107055",
"created_at": "2022-09-04T14:36:43.136863Z",
"updated_at": "2022-09-04T14:36:43.136891Z",
"structure_string": "In1 Pd3\n1.0\n3.366415 -0.000000 0.000000\n0.000000 3.366415 0.000000\n-0.000000 -0.000000 5.845250\nIn Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 In\n0.500001 0.500001 0.251049 Pd\n0.500001 0.500001 0.748951 Pd\n0.000000 0.000000 0.500000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Pd"
],
"chemical_system": "In-Pd",
"density": 10.88124216614857,
"density_atomic": 0.06038396047792259,
"volume": 66.24275665824318,
"volume_molar": 9.97308012315919,
"formula_full": "In1 Pd3",
"formula_reduced": "InPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0401917675000003,
"spacegroup": 123
},
{
"id": "jvasp-15044",
"created_at": "2022-09-04T14:36:01.915665Z",
"updated_at": "2022-09-04T14:36:01.915691Z",
"structure_string": "Ti2 Be4\n1.0\n3.933225 -0.000000 2.270848\n1.311075 3.708280 2.270848\n0.000000 0.000000 4.541697\nTi Be\n2 4\ndirect\n0.875002 0.875000 0.875000 Ti\n0.125000 0.125000 0.125000 Ti\n0.500001 0.500000 0.500000 Be\n0.500001 0.500000 -0.000000 Be\n0.000001 0.500000 0.500000 Be\n0.500001 -0.000000 0.500000 Be\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ti",
"Be"
],
"chemical_system": "Be-Ti",
"density": 3.303452940168888,
"density_atomic": 0.09057571766130595,
"volume": 66.2429197904463,
"volume_molar": 6.648736455524287,
"formula_full": "Ti2 Be4",
"formula_reduced": "TiBe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.1597001777777773,
"spacegroup": 227
},
{
"id": "jvasp-39794",
"created_at": "2022-09-04T14:37:48.921857Z",
"updated_at": "2022-09-04T14:37:48.921886Z",
"structure_string": "Li1 Zr1 Pt2\n1.0\n-0.000000 3.211545 3.211545\n3.211545 -0.000000 3.211545\n3.211545 3.211545 0.000000\nLi Zr Pt\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.750001 0.750001 0.750001 Zr\n0.000000 0.000000 0.000000 Pt\n0.500002 0.500002 0.500002 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Zr",
"Pt"
],
"chemical_system": "Li-Pt-Zr",
"density": 12.240330384439552,
"density_atomic": 0.060379284258465865,
"volume": 66.24788698847742,
"volume_molar": 9.973852512429586,
"formula_full": "Li1 Zr1 Pt2",
"formula_reduced": "LiZrPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.322331825,
"spacegroup": 225
},
{
"id": "jvasp-72184",
"created_at": "2022-09-04T14:36:05.036428Z",
"updated_at": "2022-09-04T14:36:05.036438Z",
"structure_string": "Mg2 Be1 Nb1\n1.0\n3.942828 0.000000 -0.000000\n0.000000 3.942828 0.000000\n0.000000 0.000000 4.262049\nMg Be Nb\n2 1 1\ndirect\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Be\n0.500000 0.500000 0.500000 Nb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Nb"
],
"chemical_system": "Be-Mg-Nb",
"density": 3.772540473820403,
"density_atomic": 0.0603706551424963,
"volume": 66.25735617012225,
"volume_molar": 9.975278131048267,
"formula_full": "Mg2 Be1 Nb1",
"formula_reduced": "Mg2BeNb",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4666434,
"spacegroup": 123
},
{
"id": "jvasp-90731",
"created_at": "2022-09-04T14:36:21.754804Z",
"updated_at": "2022-09-04T14:36:21.754828Z",
"structure_string": "Li2 H4 N2\n1.0\n-1.639412 -5.201203 -0.465815\n-1.639412 5.201203 -0.465815\n-1.794911 0.000000 -4.396247\nLi H N\n2 4 2\ndirect\n0.153277 0.186375 0.323603 Li\n0.186375 0.153276 0.823604 Li\n0.756879 0.429380 0.196678 H\n0.429380 0.756879 0.696678 H\n0.582245 0.910098 0.950399 H\n0.910099 0.582245 0.450399 H\n0.569777 0.769906 0.823596 N\n0.769906 0.569777 0.323595 N\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"H",
"N"
],
"chemical_system": "H-Li-N",
"density": 1.1507106425123954,
"density_atomic": 0.12070838197936828,
"volume": 66.27543066037764,
"volume_molar": 4.988999654580173,
"formula_full": "Li2 H4 N2",
"formula_reduced": "LiH2N",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6128108125,
"spacegroup": 15
},
{
"id": "jvasp-101528",
"created_at": "2022-09-04T14:36:44.615563Z",
"updated_at": "2022-09-04T14:36:44.615578Z",
"structure_string": "Li2 Mn1 Co1 O4\n1.0\n2.749206 0.047864 -0.778614\n-0.338926 4.847865 -0.902255\n-0.077529 0.045839 4.979046\nLi Mn Co O\n2 1 1 4\ndirect\n0.252470 0.757449 0.505096 Li\n0.747529 0.242549 0.494904 Li\n0.500000 0.499999 -0.000000 Mn\n0.000000 0.000000 0.000000 Co\n0.611614 0.865192 0.222963 O\n0.112652 0.370873 0.225001 O\n0.887347 0.629126 0.774999 O\n0.388385 0.134806 0.777037 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.8042340245117305,
"density_atomic": 0.1207056972458181,
"volume": 66.2769047570964,
"volume_molar": 4.989110619804353,
"formula_full": "Li2 Mn1 Co1 O4",
"formula_reduced": "Li2MnCoO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.4686090176724136,
"spacegroup": 12
}
]
}