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=3821",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=3819",
"results": [
{
"id": "jvasp-74237",
"created_at": "2022-09-04T14:36:01.993325Z",
"updated_at": "2022-09-04T14:36:01.993351Z",
"structure_string": "Zr1 Be2 In1\n1.0\n3.117160 0.000000 0.000000\n0.000000 3.117160 0.000000\n-0.000000 0.000000 6.608233\nZr Be In\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.762155 Be\n0.000000 0.000000 0.237845 Be\n0.500000 0.500000 0.000000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Be",
"In"
],
"chemical_system": "Be-In-Zr",
"density": 5.794583528140314,
"density_atomic": 0.062295468255284626,
"volume": 64.21012815263128,
"volume_molar": 9.667060748819608,
"formula_full": "Zr1 Be2 In1",
"formula_reduced": "ZrBe2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9342016675,
"spacegroup": 123
},
{
"id": "jvasp-73930",
"created_at": "2022-09-04T14:35:50.508179Z",
"updated_at": "2022-09-04T14:35:50.508210Z",
"structure_string": "Be1 Hg1 W2\n1.0\n3.212648 0.000000 -0.000000\n0.000000 3.212648 0.000000\n-0.000000 0.000000 6.221170\nBe Hg W\n1 1 2\ndirect\n0.000000 0.000000 0.465829 Be\n0.500000 0.500000 0.719160 Hg\n0.000000 0.000000 0.054090 W\n0.500000 0.500000 0.260922 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Hg",
"W"
],
"chemical_system": "Be-Hg-W",
"density": 14.92928104651039,
"density_atomic": 0.062296211275584004,
"volume": 64.20936230463401,
"volume_molar": 9.666945447708601,
"formula_full": "Be1 Hg1 W2",
"formula_reduced": "BeHgW2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.107020175,
"spacegroup": 99
},
{
"id": "jvasp-14598",
"created_at": "2022-09-04T14:36:04.023824Z",
"updated_at": "2022-09-04T14:36:04.023851Z",
"structure_string": "Y2\n1.0\n1.812173 -3.138775 -0.000000\n1.812173 3.138775 -0.000000\n0.000000 -0.000000 5.643741\nY\n2\ndirect\n0.333332 0.666666 0.250000 Y\n0.666666 0.333332 0.750000 Y\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.5988846909608165,
"density_atomic": 0.0311510783121088,
"volume": 64.20323495583702,
"volume_molar": 19.332045907570148,
"formula_full": "Y2",
"formula_reduced": "Y",
"formula_anonymous": "A",
"energy_above_hull": 9.999999999621425e-06,
"spacegroup": 194
},
{
"id": "jvasp-78751",
"created_at": "2022-09-04T14:37:09.448393Z",
"updated_at": "2022-09-04T14:37:09.448412Z",
"structure_string": "Li1 Ag1 Te1\n1.0\n3.892368 -0.000000 2.247260\n1.297456 3.669760 2.247260\n-0.000000 -0.000000 4.494519\nLi Ag Te\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.500001 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Ag",
"Te"
],
"chemical_system": "Ag-Li-Te",
"density": 6.269940492754205,
"density_atomic": 0.04672899900322029,
"volume": 64.1999628494772,
"volume_molar": 12.887373768877412,
"formula_full": "Li1 Ag1 Te1",
"formula_reduced": "LiAgTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2485383422222222,
"spacegroup": 216
},
{
"id": "jvasp-106749",
"created_at": "2022-09-04T14:36:55.288501Z",
"updated_at": "2022-09-04T14:36:55.288526Z",
"structure_string": "Sb1 Te1\n1.0\n3.687049 -0.250155 2.563594\n1.205484 3.493382 2.563594\n-0.377369 -0.250155 4.474812\nSb Te\n1 1\ndirect\n0.500000 0.499998 0.500000 Sb\n0.000000 0.000000 0.000000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sb",
"Te"
],
"chemical_system": "Sb-Te",
"density": 6.44980058822094,
"density_atomic": 0.03115303739943866,
"volume": 64.19919747652078,
"volume_molar": 19.33083019413225,
"formula_full": "Sb1 Te1",
"formula_reduced": "SbTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.8407719333333336,
"spacegroup": 225
},
{
"id": "jvasp-1050",
"created_at": "2022-09-04T14:37:48.340183Z",
"updated_at": "2022-09-04T14:37:48.340203Z",
"structure_string": "Y2\n1.0\n1.812132 -3.138704 0.000000\n1.812132 3.138704 0.000000\n0.000000 0.000000 5.643514\nY\n2\ndirect\n0.333333 0.666666 0.250000 Y\n0.666666 0.333333 0.749999 Y\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.599277764913106,
"density_atomic": 0.031153740844068845,
"volume": 64.19774787273313,
"volume_molar": 19.330393708229472,
"formula_full": "Y2",
"formula_reduced": "Y",
"formula_anonymous": "A",
"energy_above_hull": 4.549999999881038e-06,
"spacegroup": 194
},
{
"id": "jvasp-107684",
"created_at": "2022-09-04T14:36:48.796772Z",
"updated_at": "2022-09-04T14:36:48.796791Z",
"structure_string": "Pa1 Zn1 Ni2\n1.0\n3.892265 0.000000 2.247200\n1.297422 3.669662 2.247200\n0.000000 0.000000 4.494400\nPa Zn Ni\n1 1 2\ndirect\n0.499999 0.500000 0.500000 Pa\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Ni\n0.749999 0.750000 0.750001 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pa",
"Zn",
"Ni"
],
"chemical_system": "Ni-Pa-Zn",
"density": 10.704654235566977,
"density_atomic": 0.062310294481072344,
"volume": 64.19484987693419,
"volume_molar": 9.664760550649158,
"formula_full": "Pa1 Zn1 Ni2",
"formula_reduced": "PaZnNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.230249575,
"spacegroup": 225
},
{
"id": "jvasp-39914",
"created_at": "2022-09-04T14:37:44.438003Z",
"updated_at": "2022-09-04T14:37:44.438037Z",
"structure_string": "Hf1 Ga1 Ir2\n1.0\n-0.000000 3.177919 3.177919\n3.177919 -0.000000 3.177919\n3.177919 3.177919 0.000000\nHf Ga Ir\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Hf\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Ir\n0.500001 0.500001 0.500001 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Ga",
"Ir"
],
"chemical_system": "Ga-Hf-Ir",
"density": 16.366359407584078,
"density_atomic": 0.06231628071596446,
"volume": 64.1886831826801,
"volume_molar": 9.663832133128608,
"formula_full": "Hf1 Ga1 Ir2",
"formula_reduced": "HfGaIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.38695938125,
"spacegroup": 225
},
{
"id": "jvasp-81595",
"created_at": "2022-09-04T14:37:14.201475Z",
"updated_at": "2022-09-04T14:37:14.201501Z",
"structure_string": "Zn1 Si1 Tc2\n1.0\n-9.755085 -0.000001 -5.632100\n-6.132159 0.132397 -0.642990\n-5.358161 2.321596 -1.983595\nZn Si Tc\n1 1 2\ndirect\n0.500000 -0.000000 0.000000 Zn\n0.000000 0.000000 0.000000 Si\n0.789650 -0.000001 0.000000 Tc\n0.210350 -0.000000 0.000000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Si",
"Tc"
],
"chemical_system": "Si-Tc-Zn",
"density": 7.489523682771464,
"density_atomic": 0.062319616930325054,
"volume": 64.18524690984708,
"volume_molar": 9.663314790161355,
"formula_full": "Zn1 Si1 Tc2",
"formula_reduced": "ZnSiTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.2303455000000003,
"spacegroup": 71
},
{
"id": "jvasp-75496",
"created_at": "2022-09-04T14:36:10.740030Z",
"updated_at": "2022-09-04T14:36:10.740057Z",
"structure_string": "As1 P1 Pd2\n1.0\n-0.000000 3.177847 3.177847\n3.177847 0.000000 3.177847\n3.177847 3.177847 -0.000000\nAs P Pd\n1 1 2\ndirect\n0.500001 0.500001 0.500001 As\n0.750001 0.750001 0.750001 P\n0.000000 0.000000 0.000000 Pd\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"As",
"P",
"Pd"
],
"chemical_system": "As-P-Pd",
"density": 8.246134209662667,
"density_atomic": 0.062320516483641564,
"volume": 64.18432044044364,
"volume_molar": 9.66317530693242,
"formula_full": "As1 P1 Pd2",
"formula_reduced": "AsPPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1942246625000004,
"spacegroup": 216
},
{
"id": "jvasp-74263",
"created_at": "2022-09-04T14:36:17.486526Z",
"updated_at": "2022-09-04T14:36:17.486557Z",
"structure_string": "La1 Be2 Co1\n1.0\n-2.247279 2.247279 3.177255\n2.247279 -2.247279 3.177255\n2.247279 2.247279 -3.177255\nLa Be Co\n1 2 1\ndirect\n0.750001 0.250000 0.500000 La\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500000 Be\n0.500001 0.500001 0.000000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Be",
"Co"
],
"chemical_system": "Be-Co-La",
"density": 5.584718846466351,
"density_atomic": 0.06232093224276527,
"volume": 64.18389225017334,
"volume_molar": 9.663110841380425,
"formula_full": "La1 Be2 Co1",
"formula_reduced": "LaBe2Co",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.321804525,
"spacegroup": 216
},
{
"id": "jvasp-93235",
"created_at": "2022-09-04T14:36:01.874295Z",
"updated_at": "2022-09-04T14:36:01.874327Z",
"structure_string": "Ba1 Cu1 O3\n1.0\n4.003691 0.000000 0.000000\n0.000000 4.003691 0.000000\n0.000000 0.000000 4.003691\nBa Cu O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"O"
],
"chemical_system": "Ba-Cu-O",
"density": 6.439350784555453,
"density_atomic": 0.07790912898119681,
"volume": 64.17733153205626,
"volume_molar": 7.7296984817445855,
"formula_full": "Ba1 Cu1 O3",
"formula_reduced": "BaCuO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.101177384,
"spacegroup": 221
}
]
}