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=nsites&page=917",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=915",
"results": [
{
"id": "jvasp-15418",
"created_at": "2022-09-04T14:36:52.979434Z",
"updated_at": "2022-09-04T14:36:52.979454Z",
"structure_string": "Ti1 Co2 Ge1\n1.0\n3.573217 0.000000 2.062997\n1.191072 3.368862 2.062997\n0.000000 0.000000 4.125996\nTi Co Ge\n1 2 1\ndirect\n0.500000 0.500000 0.500001 Ti\n0.750000 0.750000 0.750002 Co\n0.250000 0.250000 0.250001 Co\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Ti",
"density": 7.969580375106716,
"density_atomic": 0.08053572562543483,
"volume": 49.66739877161693,
"volume_molar": 7.477601664643206,
"formula_full": "Ti1 Co2 Ge1",
"formula_reduced": "TiCo2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6751215208333337,
"spacegroup": 225
},
{
"id": "jvasp-106474",
"created_at": "2022-09-04T14:36:52.991594Z",
"updated_at": "2022-09-04T14:36:52.991610Z",
"structure_string": "Ba2 O2\n1.0\n4.573523 -0.000000 0.000000\n-2.286762 3.960787 0.000000\n0.000000 0.000000 5.615044\nBa O\n2 2\ndirect\n0.333334 0.666667 0.937592 Ba\n0.666666 0.333334 0.437592 Ba\n0.333334 0.666667 0.437407 O\n0.666666 0.333334 0.937407 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"O"
],
"chemical_system": "Ba-O",
"density": 5.006226708047663,
"density_atomic": 0.03932551983579217,
"volume": 101.71512078422407,
"volume_molar": 15.313569369574974,
"formula_full": "Ba2 O2",
"formula_reduced": "BaO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0359699999999998,
"spacegroup": 194
},
{
"id": "jvasp-79988",
"created_at": "2022-09-04T14:36:53.040332Z",
"updated_at": "2022-09-04T14:36:53.040361Z",
"structure_string": "Ti1 Mn2 W1\n1.0\n-0.000000 2.973901 2.973901\n2.973901 0.000000 2.973901\n2.973901 2.973901 -0.000000\nTi Mn W\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Ti\n0.000000 0.000000 0.000000 Mn\n0.500001 0.500001 0.500001 Mn\n0.750000 0.750000 0.750000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"W"
],
"chemical_system": "Mn-Ti-W",
"density": 10.782909094350424,
"density_atomic": 0.07604146492252054,
"volume": 52.60287928534311,
"volume_molar": 7.9195485859406105,
"formula_full": "Ti1 Mn2 W1",
"formula_reduced": "TiMn2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.978115704022988,
"spacegroup": 225
},
{
"id": "jvasp-106542",
"created_at": "2022-09-04T14:36:57.965976Z",
"updated_at": "2022-09-04T14:36:57.966003Z",
"structure_string": "K3 Rb1\n1.0\n6.432522 -0.000000 3.713818\n2.144174 6.064640 3.713818\n-0.000000 -0.000000 7.427636\nK Rb\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.749999 0.750000 0.750001 K\n0.500000 0.500000 0.500001 K\n0.000000 0.000000 0.000000 Rb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"Rb"
],
"chemical_system": "K-Rb",
"density": 1.1619842577967927,
"density_atomic": 0.013804576016742027,
"volume": 289.7589897110094,
"volume_molar": 43.62423556287726,
"formula_full": "K3 Rb1",
"formula_reduced": "K3Rb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0005625,
"spacegroup": 225
},
{
"id": "jvasp-105217",
"created_at": "2022-09-04T14:36:53.058973Z",
"updated_at": "2022-09-04T14:36:53.058997Z",
"structure_string": "Na3 Zn1\n1.0\n4.812663 0.000000 0.000000\n0.000000 4.812663 0.000000\n0.000000 -0.000000 4.812663\nNa Zn\n3 1\ndirect\n0.500000 0.500000 -0.000000 Na\n0.500000 0.000000 0.500000 Na\n-0.000000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Zn"
],
"chemical_system": "Na-Zn",
"density": 2.001805645718838,
"density_atomic": 0.03588423033634634,
"volume": 111.4695776531255,
"volume_molar": 16.782137177121808,
"formula_full": "Na3 Zn1",
"formula_reduced": "Na3Zn",
"formula_anonymous": "AB3",
"energy_above_hull": 0.00284,
"spacegroup": 221
},
{
"id": "jvasp-12135",
"created_at": "2022-09-04T14:36:53.099626Z",
"updated_at": "2022-09-04T14:36:53.099648Z",
"structure_string": "Tb2 Cl2\n1.0\n3.696790 0.023273 8.733753\n1.791088 3.234007 8.733753\n0.039210 0.023273 9.483836\nTb Cl\n2 2\ndirect\n0.116418 0.116418 0.116418 Tb\n0.883583 0.883581 0.883582 Tb\n0.613494 0.613493 0.613493 Cl\n0.386507 0.386507 0.386507 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tb",
"Cl"
],
"chemical_system": "Cl-Tb",
"density": 5.789580880081604,
"density_atomic": 0.03587402713656632,
"volume": 111.5012815475854,
"volume_molar": 16.786910309998753,
"formula_full": "Tb2 Cl2",
"formula_reduced": "TbCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-104550",
"created_at": "2022-09-04T14:36:53.130312Z",
"updated_at": "2022-09-04T14:36:53.130336Z",
"structure_string": "Ac3 Au1\n1.0\n5.225112 -0.000000 0.000000\n0.000000 5.225112 0.000000\n-0.000000 -0.000000 5.225112\nAc Au\n3 1\ndirect\n-0.000000 0.500000 0.500000 Ac\n0.500000 0.000000 0.500000 Ac\n0.500000 0.500000 -0.000000 Ac\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ac",
"Au"
],
"chemical_system": "Ac-Au",
"density": 10.219749830841662,
"density_atomic": 0.02803968816474753,
"volume": 142.6549388316286,
"volume_molar": 21.477203043831434,
"formula_full": "Ac3 Au1",
"formula_reduced": "Ac3Au",
"formula_anonymous": "AB3",
"energy_above_hull": 0.6242793925000001,
"spacegroup": 221
},
{
"id": "jvasp-105142",
"created_at": "2022-09-04T14:36:53.163429Z",
"updated_at": "2022-09-04T14:36:53.163446Z",
"structure_string": "Ce1 Sm1 Tl2\n1.0\n4.739906 0.000000 2.736586\n1.579969 4.468826 2.736586\n0.000000 0.000000 5.473172\nCe Sm Tl\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Sm\n0.250000 0.250000 0.250000 Tl\n0.750001 0.750001 0.750000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Sm",
"Tl"
],
"chemical_system": "Ce-Sm-Tl",
"density": 10.015547749753445,
"density_atomic": 0.03450306852492116,
"volume": 115.93171769956771,
"volume_molar": 17.453928063384502,
"formula_full": "Ce1 Sm1 Tl2",
"formula_reduced": "CeSmTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5210998937500001,
"spacegroup": 225
},
{
"id": "jvasp-51234",
"created_at": "2022-09-04T14:36:53.168749Z",
"updated_at": "2022-09-04T14:36:53.168767Z",
"structure_string": "Be2 Cd1 P1\n1.0\n0.000000 3.058233 3.058233\n3.058233 0.000000 3.058233\n3.058233 3.058233 -0.000000\nBe Cd P\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Be\n0.749999 0.749999 0.749999 Be\n0.000000 0.000000 0.000000 Cd\n0.499999 0.499999 0.499999 P\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"P"
],
"chemical_system": "Be-Cd-P",
"density": 4.685279209588473,
"density_atomic": 0.06992271529874705,
"volume": 57.20601642699187,
"volume_molar": 8.612567081055433,
"formula_full": "Be2 Cd1 P1",
"formula_reduced": "Be2CdP",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3672693625,
"spacegroup": 225
},
{
"id": "jvasp-19877",
"created_at": "2022-09-04T14:36:53.178687Z",
"updated_at": "2022-09-04T14:36:53.178708Z",
"structure_string": "Np1 Sn3\n1.0\n4.664576 -0.000000 -0.000000\n-0.000000 4.664576 -0.000000\n0.000000 -0.000000 4.664576\nNp Sn\n1 3\ndirect\n0.000000 0.000000 0.000000 Np\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Np",
"Sn"
],
"chemical_system": "Np-Sn",
"density": 9.704260987596777,
"density_atomic": 0.039411545974258715,
"volume": 101.49310059068891,
"volume_molar": 15.280143448149195,
"formula_full": "Np1 Sn3",
"formula_reduced": "NpSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.043146275,
"spacegroup": 221
},
{
"id": "jvasp-102468",
"created_at": "2022-09-04T14:36:53.187921Z",
"updated_at": "2022-09-04T14:36:53.187942Z",
"structure_string": "Ce2 Hg1 Pb1\n1.0\n4.756599 -0.000000 2.746224\n1.585533 4.484564 2.746224\n-0.000000 -0.000000 5.492447\nCe Hg Pb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ce\n0.750000 0.749999 0.750000 Ce\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Hg",
"Pb"
],
"chemical_system": "Ce-Hg-Pb",
"density": 9.751440640568248,
"density_atomic": 0.034141087448122595,
"volume": 117.16088440586442,
"volume_molar": 17.638983436455113,
"formula_full": "Ce2 Hg1 Pb1",
"formula_reduced": "Ce2HgPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.641926605,
"spacegroup": 225
},
{
"id": "jvasp-51161",
"created_at": "2022-09-04T14:36:53.220154Z",
"updated_at": "2022-09-04T14:36:53.220179Z",
"structure_string": "Re1 Sn2 Se1\n1.0\n-0.000000 3.451937 3.451937\n3.451937 -0.000000 3.451937\n3.451937 3.451937 0.000000\nRe Sn Se\n1 2 1\ndirect\n0.500001 0.500001 0.500001 Re\n0.000000 0.000000 0.000000 Sn\n0.750001 0.750001 0.750001 Sn\n0.250000 0.250000 0.250000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Re",
"Sn",
"Se"
],
"chemical_system": "Re-Se-Sn",
"density": 10.144759827179293,
"density_atomic": 0.04862296213533535,
"volume": 82.26565853529343,
"volume_molar": 12.385384385340812,
"formula_full": "Re1 Sn2 Se1",
"formula_reduced": "ReSn2Se",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4696186916666667,
"spacegroup": 216
}
]
}