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=nelements&page=560",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=558",
"results": [
{
"id": "jvasp-18536",
"created_at": "2022-09-04T14:36:59.916858Z",
"updated_at": "2022-09-04T14:36:59.916891Z",
"structure_string": "Pu4 Ga4\n1.0\n5.533985 -0.209551 -2.753478\n-3.359080 5.149235 -0.672683\n-0.136700 0.209551 6.179640\nPu Ga\n4 4\ndirect\n0.500000 0.955638 0.455637 Pu\n0.500000 0.455637 0.955637 Pu\n0.000000 0.404288 0.404288 Pu\n0.000000 0.006951 0.006951 Pu\n0.418764 0.915005 0.915005 Ga\n0.000000 0.915005 0.496241 Ga\n0.000000 0.496241 0.915005 Ga\n0.581236 0.496241 0.496240 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pu",
"Ga"
],
"chemical_system": "Ga-Pu",
"density": 12.079655773156615,
"density_atomic": 0.04637555258838849,
"volume": 172.50468303860254,
"volume_molar": 12.985593537720613,
"formula_full": "Pu4 Ga4",
"formula_reduced": "PuGa",
"formula_anonymous": "AB",
"energy_above_hull": 2.3293311624999995,
"spacegroup": 139
},
{
"id": "jvasp-100154",
"created_at": "2022-09-04T14:36:53.583624Z",
"updated_at": "2022-09-04T14:36:53.583651Z",
"structure_string": "Cd1 Pd3\n1.0\n4.022728 -0.000000 0.000000\n0.000000 4.022728 -0.000000\n-0.000000 -0.000000 4.022728\nCd Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.000000 0.500000 0.500000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Pd"
],
"chemical_system": "Cd-Pd",
"density": 11.01133475184312,
"density_atomic": 0.06144661823842222,
"volume": 65.09715448422877,
"volume_molar": 9.800605684487273,
"formula_full": "Cd1 Pd3",
"formula_reduced": "CdPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0657238000000002,
"spacegroup": 221
},
{
"id": "jvasp-56312",
"created_at": "2022-09-04T14:36:46.722579Z",
"updated_at": "2022-09-04T14:36:46.722610Z",
"structure_string": "Tl1 Pd3\n1.0\n4.081795 0.000000 0.000000\n0.000000 4.081795 -0.000000\n-0.000000 -0.000000 4.080490\nTl Pd\n1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500001 0.000000 0.500000 Pd\n0.000000 0.500001 0.500000 Pd\n0.500001 0.500001 0.000000 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tl",
"Pd"
],
"chemical_system": "Pd-Tl",
"density": 12.7899825515332,
"density_atomic": 0.05883629201014846,
"volume": 67.98524963656878,
"volume_molar": 10.235418572878901,
"formula_full": "Tl1 Pd3",
"formula_reduced": "TlPd3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.0446149250000003,
"spacegroup": 221
},
{
"id": "jvasp-100986",
"created_at": "2022-09-04T14:36:46.726427Z",
"updated_at": "2022-09-04T14:36:46.726441Z",
"structure_string": "In6 Ge2\n1.0\n6.610331 -0.000000 0.000000\n-3.305165 5.724714 0.000000\n-0.000000 -0.000000 5.393398\nIn Ge\n6 2\ndirect\n0.170276 0.340553 0.250000 In\n0.659445 0.829723 0.250000 In\n0.170276 0.829723 0.250000 In\n0.829722 0.659446 0.750000 In\n0.340553 0.170277 0.750000 In\n0.829723 0.170277 0.750000 In\n0.333333 0.666666 0.750000 Ge\n0.666666 0.333333 0.250000 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"In",
"Ge"
],
"chemical_system": "Ge-In",
"density": 6.786933042170915,
"density_atomic": 0.03919679124875708,
"volume": 204.09833930612058,
"volume_molar": 15.363861602296234,
"formula_full": "In6 Ge2",
"formula_reduced": "In3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-57544",
"created_at": "2022-09-04T14:36:46.734248Z",
"updated_at": "2022-09-04T14:36:46.734275Z",
"structure_string": "Si6 O12\n1.0\n4.615528 -7.994330 -0.000000\n4.615528 7.994330 0.000000\n-0.000000 0.000000 5.268412\nSi O\n6 12\ndirect\n0.558305 0.116610 0.750000 Si\n0.116610 0.558305 0.250000 Si\n0.441695 0.558305 0.250000 Si\n0.441695 0.883390 0.250000 Si\n0.558305 0.441695 0.750000 Si\n0.883390 0.441695 0.750000 Si\n0.524357 0.762179 0.250000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.475643 0.237822 0.750000 O\n0.762179 0.524357 0.750000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n0.237822 0.762179 0.250000 O\n0.762179 0.237822 0.750000 O\n0.237822 0.475643 0.250000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 1.5397427440530658,
"density_atomic": 0.04629768945671636,
"volume": 388.78830047940454,
"volume_molar": 13.007432618489721,
"formula_full": "Si6 O12",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4120852000000004,
"spacegroup": 194
},
{
"id": "jvasp-42892",
"created_at": "2022-09-04T14:36:46.739382Z",
"updated_at": "2022-09-04T14:36:46.739402Z",
"structure_string": "Tc6 Ru2\n1.0\n2.751861 -4.766363 0.000000\n2.751861 4.766363 -0.000000\n0.000000 -0.000000 4.359507\nTc Ru\n6 2\ndirect\n0.164755 0.329509 0.250000 Tc\n0.670491 0.835245 0.250000 Tc\n0.164755 0.835245 0.250000 Tc\n0.835245 0.670491 0.750000 Tc\n0.329509 0.164755 0.750000 Tc\n0.835245 0.164755 0.750000 Tc\n0.333333 0.666667 0.750000 Ru\n0.666667 0.333333 0.250000 Ru\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tc",
"Ru"
],
"chemical_system": "Ru-Tc",
"density": 11.472872377566237,
"density_atomic": 0.06995342840822762,
"volume": 114.36180015816173,
"volume_molar": 8.608785726493002,
"formula_full": "Tc6 Ru2",
"formula_reduced": "Tc3Ru",
"formula_anonymous": "AB3",
"energy_above_hull": 5.19850875,
"spacegroup": 194
},
{
"id": "jvasp-100999",
"created_at": "2022-09-04T14:36:46.751160Z",
"updated_at": "2022-09-04T14:36:46.751180Z",
"structure_string": "Mg1 Ag5\n1.0\n5.062608 -0.000000 0.000000\n-2.531304 4.384347 0.000000\n-0.000000 -0.000000 4.777111\nMg Ag\n1 5\ndirect\n0.000000 0.000000 0.500000 Mg\n0.666667 0.333334 0.500000 Ag\n0.332328 0.000000 -0.000000 Ag\n0.667673 0.667673 -0.000000 Ag\n0.000000 0.332328 -0.000000 Ag\n0.333334 0.666667 0.500000 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ag"
],
"chemical_system": "Ag-Mg",
"density": 8.826956248220062,
"density_atomic": 0.05658570062859954,
"volume": 106.03385543250621,
"volume_molar": 10.642513379000722,
"formula_full": "Mg1 Ag5",
"formula_reduced": "MgAg5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 189
},
{
"id": "jvasp-78663",
"created_at": "2022-09-04T14:37:02.960536Z",
"updated_at": "2022-09-04T14:37:02.960564Z",
"structure_string": "Ba1 Cl2\n1.0\n4.494176 -0.000000 2.594713\n1.498059 4.237149 2.594713\n-0.000000 0.000000 5.189427\nBa Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750001 0.750000 0.749999 Cl\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Cl"
],
"chemical_system": "Ba-Cl",
"density": 3.4990925849153767,
"density_atomic": 0.03035834102075275,
"volume": 98.81962910783632,
"volume_molar": 19.83685721127945,
"formula_full": "Ba1 Cl2",
"formula_reduced": "BaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0065066666666666,
"spacegroup": 225
},
{
"id": "jvasp-19914",
"created_at": "2022-09-04T14:36:46.798168Z",
"updated_at": "2022-09-04T14:36:46.798193Z",
"structure_string": "Ba1 B6\n1.0\n4.276230 0.000000 -0.000000\n0.000000 4.276230 0.000000\n0.000000 0.000000 4.276230\nBa B\n1 6\ndirect\n0.000000 0.000000 0.000000 Ba\n0.205282 0.500000 0.500000 B\n0.500000 0.500000 0.794718 B\n0.500000 0.500000 0.205282 B\n0.500000 0.205282 0.500000 B\n0.500000 0.794718 0.500000 B\n0.794718 0.500000 0.500000 B\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Ba",
"B"
],
"chemical_system": "B-Ba",
"density": 4.293703445123679,
"density_atomic": 0.08951892783636042,
"volume": 78.19575333605336,
"volume_molar": 6.727226191770756,
"formula_full": "Ba1 B6",
"formula_reduced": "BaB6",
"formula_anonymous": "AB6",
"energy_above_hull": 4.272965924285714,
"spacegroup": 221
},
{
"id": "jvasp-14738",
"created_at": "2022-09-04T14:36:58.619248Z",
"updated_at": "2022-09-04T14:36:58.619270Z",
"structure_string": "Sc1 Pt3\n1.0\n4.005426 0.000000 -0.000000\n0.000000 4.005426 -0.000000\n0.000000 0.000000 4.005426\nSc Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500001 0.000000 Pt\n0.500001 0.000000 0.500001 Pt\n0.000000 0.500001 0.500001 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sc",
"Pt"
],
"chemical_system": "Pt-Sc",
"density": 16.284964305170607,
"density_atomic": 0.06224634472770885,
"volume": 64.26080145746144,
"volume_molar": 9.674689793181148,
"formula_full": "Sc1 Pt3",
"formula_reduced": "ScPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3441873625000005,
"spacegroup": 221
},
{
"id": "jvasp-18629",
"created_at": "2022-09-04T14:36:59.484603Z",
"updated_at": "2022-09-04T14:36:59.484618Z",
"structure_string": "Ba2 Tl4\n1.0\n2.666730 -4.618911 -0.000000\n2.666730 4.618911 0.000000\n0.000000 0.000000 8.520733\nBa Tl\n2 4\ndirect\n0.000000 0.000000 0.250000 Ba\n0.000000 0.000000 0.750000 Ba\n0.333333 0.666667 0.454878 Tl\n0.666667 0.333333 0.954878 Tl\n0.666667 0.333333 0.545122 Tl\n0.333333 0.666667 0.045122 Tl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Tl"
],
"chemical_system": "Ba-Tl",
"density": 8.64013616418026,
"density_atomic": 0.028584174682274907,
"volume": 209.90635786033766,
"volume_molar": 21.068093890898094,
"formula_full": "Ba2 Tl4",
"formula_reduced": "BaTl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-18598",
"created_at": "2022-09-04T14:36:44.326685Z",
"updated_at": "2022-09-04T14:36:44.326698Z",
"structure_string": "Ba1 Au2\n1.0\n2.442982 -4.231368 0.000000\n2.442982 4.231368 0.000000\n-0.000000 0.000000 4.149966\nBa Au\n1 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.500000 Au\n0.333333 0.666667 0.500000 Au\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ba",
"Au"
],
"chemical_system": "Au-Ba",
"density": 10.282074102634654,
"density_atomic": 0.03496597606889236,
"volume": 85.79769070622237,
"volume_molar": 17.222859010527166,
"formula_full": "Ba1 Au2",
"formula_reduced": "BaAu2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1395825233333332,
"spacegroup": 191
}
]
}