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=-formula_anonymous&page=1211",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=1209",
"results": [
{
"id": "jvasp-85546",
"created_at": "2022-09-04T14:36:08.300919Z",
"updated_at": "2022-09-04T14:36:08.300943Z",
"structure_string": "Li3 Ni3 O6\n1.0\n2.787670 1.609462 6.825048\n-2.787670 1.609462 6.825048\n0.000000 -3.218924 6.825048\nLi Ni O\n3 3 6\ndirect\n0.500000 0.500000 0.500000 Li\n0.166667 0.166667 0.166667 Li\n0.833333 0.833333 0.833333 Li\n0.000000 0.000000 0.000000 Ni\n0.666667 0.666667 0.666667 Ni\n0.333333 0.333333 0.333333 Ni\n0.918892 0.918892 0.918892 O\n0.081109 0.081109 0.081109 O\n0.585559 0.585559 0.585559 O\n0.747776 0.747776 0.747776 O\n0.252224 0.252224 0.252224 O\n0.414442 0.414442 0.414442 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O",
"density": 2.647212634441067,
"density_atomic": 0.06531338565882797,
"volume": 183.72956598335583,
"volume_molar": 9.220377567712305,
"formula_full": "Li3 Ni3 O6",
"formula_reduced": "LiNiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4668248499999998,
"spacegroup": 191
},
{
"id": "jvasp-73098",
"created_at": "2022-09-04T14:36:10.147670Z",
"updated_at": "2022-09-04T14:36:10.147695Z",
"structure_string": "Sc1 Be2 Te1\n1.0\n-1.937604 1.937604 4.523197\n1.937604 -1.937604 4.523197\n1.937604 1.937604 -4.523197\nSc Be Te\n1 2 1\ndirect\n0.250000 0.749999 0.499999 Sc\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.749999 0.250000 0.499999 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Te"
],
"chemical_system": "Be-Sc-Te",
"density": 4.658987120608438,
"density_atomic": 0.05888768100855732,
"volume": 67.92592154238059,
"volume_molar": 10.226486519523307,
"formula_full": "Sc1 Be2 Te1",
"formula_reduced": "ScBe2Te",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8502913041666669,
"spacegroup": 139
},
{
"id": "jvasp-71889",
"created_at": "2022-09-04T14:36:16.840799Z",
"updated_at": "2022-09-04T14:36:16.840810Z",
"structure_string": "Mn2 Be1 Sb1\n1.0\n-1.857428 1.857428 4.014153\n1.857428 -1.857428 4.014153\n1.857428 1.857428 -4.014153\nMn Be Sb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.250000 0.750000 0.500001 Mn\n0.750000 0.250000 0.500001 Be\n0.500000 0.500000 0.000000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Sb"
],
"chemical_system": "Be-Mn-Sb",
"density": 7.213631545224943,
"density_atomic": 0.07220746562623706,
"volume": 55.39593399808473,
"volume_molar": 8.340052801703395,
"formula_full": "Mn2 Be1 Sb1",
"formula_reduced": "Mn2BeSb",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.046554170689655,
"spacegroup": 119
},
{
"id": "jvasp-71265",
"created_at": "2022-09-04T14:36:08.328291Z",
"updated_at": "2022-09-04T14:36:08.328318Z",
"structure_string": "Be1 P1 Se2\n1.0\n3.069573 0.000000 0.000000\n0.000000 3.069573 0.000000\n-0.000000 0.000000 8.278166\nBe P Se\n1 1 2\ndirect\n0.000000 0.000000 0.670989 Be\n0.499999 0.499999 0.582506 P\n0.000000 0.000000 0.931664 Se\n0.499999 0.499999 0.314843 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"P",
"Se"
],
"chemical_system": "Be-P-Se",
"density": 4.2132562376753615,
"density_atomic": 0.051282587308236385,
"volume": 77.99918471269426,
"volume_molar": 11.743051737627125,
"formula_full": "Be1 P1 Se2",
"formula_reduced": "BePSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8882395833333332,
"spacegroup": 99
},
{
"id": "jvasp-92223",
"created_at": "2022-09-04T14:36:10.140109Z",
"updated_at": "2022-09-04T14:36:10.140130Z",
"structure_string": "Li2 Nd2 Se4\n1.0\n8.290018 -0.000000 0.000000\n8.290018 7.178574 -0.001546\n4.145009 4.784975 3.383441\nLi Nd Se\n2 2 4\ndirect\n0.499998 0.000000 0.000000 Li\n0.250002 0.500000 -0.000001 Li\n-0.000018 0.000000 0.000000 Nd\n0.750019 0.500000 -0.000001 Nd\n0.251424 -0.000010 0.497160 Se\n0.001437 0.499990 0.497159 Se\n0.748564 0.000009 0.502840 Se\n0.498577 0.500009 0.502839 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Nd",
"Se"
],
"chemical_system": "Li-Nd-Se",
"density": 5.0968023913429885,
"density_atomic": 0.039719655179249844,
"volume": 201.4116175957973,
"volume_molar": 15.161613898264804,
"formula_full": "Li2 Nd2 Se4",
"formula_reduced": "LiNdSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8452445583333333,
"spacegroup": 141
},
{
"id": "jvasp-66536",
"created_at": "2022-09-04T14:36:01.340127Z",
"updated_at": "2022-09-04T14:36:01.340165Z",
"structure_string": "Ba2 Pd1 Br1\n1.0\n-0.000000 3.996902 3.996902\n3.996902 0.000000 3.996902\n3.996902 3.996902 0.000000\nBa Pd Br\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Pd",
"Br"
],
"chemical_system": "Ba-Br-Pd",
"density": 5.9941664887140105,
"density_atomic": 0.03132272199227323,
"volume": 127.70282228302925,
"volume_molar": 19.226109280941667,
"formula_full": "Ba2 Pd1 Br1",
"formula_reduced": "Ba2PdBr",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.00602793625,
"spacegroup": 225
},
{
"id": "jvasp-69199",
"created_at": "2022-09-04T14:36:16.854716Z",
"updated_at": "2022-09-04T14:36:16.854731Z",
"structure_string": "Ba2 Tl1 Cd1\n1.0\n-0.000000 4.230486 4.230486\n4.230486 -0.000000 4.230486\n4.230486 4.230486 -0.000000\nBa Tl Cd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500001 0.500001 0.500001 Tl\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Cd"
],
"chemical_system": "Ba-Cd-Tl",
"density": 6.485823158974993,
"density_atomic": 0.026415522723668705,
"volume": 151.42611569128405,
"volume_molar": 22.79773458582393,
"formula_full": "Ba2 Tl1 Cd1",
"formula_reduced": "Ba2TlCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4999999999886224e-06,
"spacegroup": 225
},
{
"id": "jvasp-70651",
"created_at": "2022-09-04T14:36:08.371850Z",
"updated_at": "2022-09-04T14:36:08.371883Z",
"structure_string": "Mg1 Be2 Os1\n1.0\n-1.693244 1.693244 4.134870\n1.693244 -1.693244 4.134870\n1.693244 1.693244 -4.134870\nMg Be Os\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.749999 0.250000 0.499999 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Os"
],
"chemical_system": "Be-Mg-Os",
"density": 8.143704124185943,
"density_atomic": 0.08435271187031337,
"volume": 47.4199336489588,
"volume_molar": 7.139237881597259,
"formula_full": "Mg1 Be2 Os1",
"formula_reduced": "MgBe2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1999515625000003,
"spacegroup": 119
},
{
"id": "jvasp-18552",
"created_at": "2022-09-04T14:36:08.397794Z",
"updated_at": "2022-09-04T14:36:08.397820Z",
"structure_string": "Ni2 Ge2 Pt4\n1.0\n4.734370 0.013431 -2.563163\n-1.615707 4.450160 -2.563163\n-0.002679 -0.003834 5.450100\nNi Ge Pt\n2 2 4\ndirect\n0.198409 0.801591 0.000000 Ni\n0.801591 0.198409 0.000000 Ni\n0.765744 0.765745 0.531490 Ge\n0.234255 0.234256 0.468510 Ge\n0.696725 0.696726 0.000000 Pt\n0.750000 0.250000 0.500000 Pt\n0.303274 0.303274 0.000000 Pt\n0.249999 0.750000 0.500000 Pt\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ni",
"Ge",
"Pt"
],
"chemical_system": "Ge-Ni-Pt",
"density": 15.079822094611393,
"density_atomic": 0.06965489359828435,
"volume": 114.85194487752467,
"volume_molar": 8.645682232652682,
"formula_full": "Ni2 Ge2 Pt4",
"formula_reduced": "NiGePt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6941577875,
"spacegroup": 69
},
{
"id": "jvasp-74053",
"created_at": "2022-09-04T14:36:10.115071Z",
"updated_at": "2022-09-04T14:36:10.115089Z",
"structure_string": "Be1 Cd1 Mo2\n1.0\n3.179735 0.000000 0.000000\n0.000000 3.179735 0.000000\n-0.000000 0.000000 6.252543\nBe Cd Mo\n1 1 2\ndirect\n0.000000 0.000000 0.463597 Be\n0.499999 0.499999 0.724871 Cd\n0.000000 0.000000 0.052565 Mo\n0.499999 0.499999 0.258967 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Mo"
],
"chemical_system": "Be-Cd-Mo",
"density": 8.229536229665799,
"density_atomic": 0.06327344046150646,
"volume": 63.217678236312636,
"volume_molar": 9.517643921486581,
"formula_full": "Be1 Cd1 Mo2",
"formula_reduced": "BeCdMo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0473319125,
"spacegroup": 99
},
{
"id": "jvasp-71078",
"created_at": "2022-09-04T14:36:08.543113Z",
"updated_at": "2022-09-04T14:36:08.543144Z",
"structure_string": "Be1 Tc2 Hg1\n1.0\n2.961179 0.000000 0.000000\n0.000000 2.961179 0.000000\n0.000000 0.000000 6.731630\nBe Tc Hg\n1 2 1\ndirect\n0.000000 0.000000 0.458514 Be\n0.000000 0.000000 0.049599 Tc\n0.500000 0.500000 0.269246 Tc\n0.500000 0.500000 0.722641 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tc",
"Hg"
],
"chemical_system": "Be-Hg-Tc",
"density": 11.410372468607957,
"density_atomic": 0.06776577859113408,
"volume": 59.0268433885201,
"volume_molar": 8.886698987603586,
"formula_full": "Be1 Tc2 Hg1",
"formula_reduced": "BeTc2Hg",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.816070925,
"spacegroup": 99
},
{
"id": "jvasp-68609",
"created_at": "2022-09-04T14:36:08.567211Z",
"updated_at": "2022-09-04T14:36:08.567228Z",
"structure_string": "Hf1 Be1 Pb2\n1.0\n-2.085415 2.085415 4.993463\n2.085415 -2.085415 4.993463\n2.085415 2.085415 -4.993463\nHf Be Pb\n1 1 2\ndirect\n0.750001 0.250000 0.500001 Hf\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Pb\n0.250000 0.750001 0.500001 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Be",
"Pb"
],
"chemical_system": "Be-Hf-Pb",
"density": 11.506101521055843,
"density_atomic": 0.04604825505191075,
"volume": 86.86539795027525,
"volume_molar": 13.077891340749325,
"formula_full": "Hf1 Be1 Pb2",
"formula_reduced": "HfBePb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.056322685,
"spacegroup": 119
}
]
}