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=151",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=149",
"results": [
{
"id": "jvasp-36425",
"created_at": "2022-09-04T14:37:28.794681Z",
"updated_at": "2022-09-04T14:37:28.794699Z",
"structure_string": "Tc1 C1\n1.0\n2.309782 2.309782 -0.000000\n2.309782 0.000000 -2.309782\n-0.000000 2.309782 -2.309782\nTc C\n1 1\ndirect\n0.000000 0.000000 0.000000 Tc\n0.749999 0.749999 0.749999 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tc",
"C"
],
"chemical_system": "C-Tc",
"density": 7.412096282622736,
"density_atomic": 0.08114971935648504,
"volume": 24.64580303986191,
"volume_molar": 7.4210247524642154,
"formula_full": "Tc1 C1",
"formula_reduced": "TcC",
"formula_anonymous": "AB",
"energy_above_hull": 4.073040749999999,
"spacegroup": 216
},
{
"id": "jvasp-35889",
"created_at": "2022-09-04T14:37:28.794724Z",
"updated_at": "2022-09-04T14:37:28.794746Z",
"structure_string": "Hf5 Pb1\n1.0\n3.182359 0.000000 0.000000\n0.000000 3.182359 0.000000\n0.000000 0.000000 13.533229\nHf Pb\n5 1\ndirect\n0.500000 0.500000 0.337286 Hf\n0.500000 0.500000 0.662714 Hf\n0.000000 0.000000 0.180094 Hf\n0.000000 0.000000 0.819906 Hf\n0.000000 0.000000 0.500000 Hf\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hf",
"Pb"
],
"chemical_system": "Hf-Pb",
"density": 13.323054491514585,
"density_atomic": 0.04377755260061546,
"volume": 137.05654253307088,
"volume_molar": 13.75622985355133,
"formula_full": "Hf5 Pb1",
"formula_reduced": "Hf5Pb",
"formula_anonymous": "AB5",
"energy_above_hull": 5.12031597,
"spacegroup": 123
},
{
"id": "jvasp-35047",
"created_at": "2022-09-04T14:37:33.329500Z",
"updated_at": "2022-09-04T14:37:33.329532Z",
"structure_string": "Re2 C4\n1.0\n2.582147 0.000000 0.000000\n-1.291074 2.236213 0.000000\n0.000000 0.000000 10.096062\nRe C\n2 4\ndirect\n0.333496 0.666990 0.250000 Re\n0.666506 0.333009 0.750000 Re\n0.333339 0.666677 0.014896 C\n0.666663 0.333322 0.985103 C\n0.666663 0.333322 0.514896 C\n0.333339 0.666677 0.485104 C\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"C"
],
"chemical_system": "C-Re",
"density": 11.97634611569519,
"density_atomic": 0.1029212639074263,
"volume": 58.29699104158659,
"volume_molar": 5.851211432281557,
"formula_full": "Re2 C4",
"formula_reduced": "ReC2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.874345999999999,
"spacegroup": 194
},
{
"id": "jvasp-34249",
"created_at": "2022-09-04T14:37:16.401574Z",
"updated_at": "2022-09-04T14:37:16.401600Z",
"structure_string": "Hf1 O2\n1.0\n3.100581 -0.000000 1.790122\n1.033527 2.923257 1.790122\n-0.000000 -0.000000 3.580243\nHf O\n1 2\ndirect\n0.000000 0.000000 0.000000 Hf\n0.750000 0.750001 0.749998 O\n0.250000 0.250000 0.249999 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hf",
"O"
],
"chemical_system": "Hf-O",
"density": 10.77098709781082,
"density_atomic": 0.09244824491789073,
"volume": 32.450589004307155,
"volume_molar": 6.514067157628198,
"formula_full": "Hf1 O2",
"formula_reduced": "HfO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.802843333333333,
"spacegroup": 225
},
{
"id": "jvasp-23863",
"created_at": "2022-09-04T14:37:34.047094Z",
"updated_at": "2022-09-04T14:37:34.047124Z",
"structure_string": "Ca2 Cl4\n1.0\n6.384320 -0.000000 0.000000\n-0.000000 6.384320 0.000000\n0.000000 0.000000 4.160853\nCa Cl\n2 4\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.697516 0.697516 0.000000 Cl\n0.197516 0.802484 0.500000 Cl\n0.302484 0.302484 0.000000 Cl\n0.802484 0.197516 0.500000 Cl\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Cl"
],
"chemical_system": "Ca-Cl",
"density": 2.173340633346305,
"density_atomic": 0.03537851370817952,
"volume": 169.59446203679263,
"volume_molar": 17.02202870836736,
"formula_full": "Ca2 Cl4",
"formula_reduced": "CaCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0020299999999999,
"spacegroup": 136
},
{
"id": "jvasp-35985",
"created_at": "2022-09-04T14:37:16.406217Z",
"updated_at": "2022-09-04T14:37:16.406242Z",
"structure_string": "W1 N1\n1.0\n2.338327 2.338327 0.000000\n2.338327 -0.000000 -2.338327\n-0.000000 2.338327 -2.338327\nW N\n1 1\ndirect\n0.000000 0.000000 0.000000 W\n0.750001 0.750001 0.750001 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"W",
"N"
],
"chemical_system": "N-W",
"density": 12.847900942184415,
"density_atomic": 0.07821395855590135,
"volume": 25.570883214797945,
"volume_molar": 7.699572903851727,
"formula_full": "W1 N1",
"formula_reduced": "WN",
"formula_anonymous": "AB",
"energy_above_hull": 4.383051624999999,
"spacegroup": 216
},
{
"id": "jvasp-4273",
"created_at": "2022-09-04T14:37:17.211498Z",
"updated_at": "2022-09-04T14:37:17.211518Z",
"structure_string": "As4 Cl12\n1.0\n4.086803 0.000000 0.000000\n0.000000 9.462370 0.000000\n0.000000 0.000000 11.400438\nAs Cl\n4 12\ndirect\n-0.005166 0.698036 0.787697 As\n0.494833 0.801964 0.212303 As\n0.005166 0.198036 0.712303 As\n0.505166 0.301964 0.287697 As\n0.254703 0.515135 0.867764 Cl\n0.754702 0.984865 0.132236 Cl\n0.745296 0.015135 0.632236 Cl\n0.245297 0.484865 0.367764 Cl\n0.226779 0.297287 0.120063 Cl\n0.726778 0.202713 0.879937 Cl\n0.773220 0.797287 0.379937 Cl\n0.273221 0.702713 0.620063 Cl\n0.232409 0.132748 0.383313 Cl\n0.732409 0.367252 0.616687 Cl\n0.767590 0.632748 0.116687 Cl\n0.267590 0.867252 0.883313 Cl\n",
"nsites": 16,
"nelements": 2,
"elements": [
"As",
"Cl"
],
"chemical_system": "As-Cl",
"density": 2.731210995703318,
"density_atomic": 0.0362923270710029,
"volume": 440.8645378042951,
"volume_molar": 16.59342689218629,
"formula_full": "As4 Cl12",
"formula_reduced": "AsCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.478570988125,
"spacegroup": 19
},
{
"id": "jvasp-85124",
"created_at": "2022-09-04T14:37:16.410528Z",
"updated_at": "2022-09-04T14:37:16.410549Z",
"structure_string": "Ge4 Se4\n1.0\n3.896878 0.000000 0.000000\n0.000000 4.478697 0.000000\n0.000000 0.000000 11.151670\nGe Se\n4 4\ndirect\n0.250000 0.121278 0.125297 Ge\n0.750000 0.878723 0.874703 Ge\n0.750000 0.621278 0.374703 Ge\n0.250000 0.378722 0.625297 Ge\n0.250000 0.493059 0.853576 Se\n0.750000 0.506941 0.146424 Se\n0.750000 -0.006941 0.646424 Se\n0.250000 0.006941 0.353577 Se\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ge",
"Se"
],
"chemical_system": "Ge-Se",
"density": 5.173683883508369,
"density_atomic": 0.04110376333113182,
"volume": 194.6293806616202,
"volume_molar": 14.651069079698734,
"formula_full": "Ge4 Se4",
"formula_reduced": "GeSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.5994546583333333,
"spacegroup": 62
},
{
"id": "jvasp-79126",
"created_at": "2022-09-04T14:37:16.450234Z",
"updated_at": "2022-09-04T14:37:16.450254Z",
"structure_string": "Al3 Tl1\n1.0\n4.389260 -0.000000 -0.000000\n-0.000000 4.389260 -0.000000\n-0.000000 -0.000000 4.389260\nAl Tl\n3 1\ndirect\n0.000000 0.500002 0.500002 Al\n0.500002 0.000000 0.500002 Al\n0.500002 0.500002 0.000000 Al\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Al",
"Tl"
],
"chemical_system": "Al-Tl",
"density": 5.602984741490817,
"density_atomic": 0.047302715132439783,
"volume": 84.56174214948679,
"volume_molar": 12.731067853375862,
"formula_full": "Al3 Tl1",
"formula_reduced": "Al3Tl",
"formula_anonymous": "AB3",
"energy_above_hull": 1.1718277500000005,
"spacegroup": 221
},
{
"id": "jvasp-69",
"created_at": "2022-09-04T14:37:12.057534Z",
"updated_at": "2022-09-04T14:37:12.057556Z",
"structure_string": "Nb2 Se4\n1.0\n1.745987 -3.024137 0.000000\n1.745987 3.024137 0.000000\n0.000000 0.000000 12.678071\nNb Se\n2 4\ndirect\n0.000000 0.000000 0.250000 Nb\n0.000000 0.000000 0.750000 Nb\n0.333334 0.666668 0.882574 Se\n0.666668 0.333334 0.382574 Se\n0.333334 0.666668 0.617426 Se\n0.666668 0.333334 0.117426 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Se"
],
"chemical_system": "Nb-Se",
"density": 6.221952061606606,
"density_atomic": 0.0448152277243516,
"volume": 133.8830639644331,
"volume_molar": 13.437710942898331,
"formula_full": "Nb2 Se4",
"formula_reduced": "NbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.160592044444445,
"spacegroup": 194
},
{
"id": "jvasp-122",
"created_at": "2022-09-04T14:37:33.940382Z",
"updated_at": "2022-09-04T14:37:33.940398Z",
"structure_string": "Sn1 Se2\n1.0\n1.943608 -3.366429 -0.000000\n1.943608 3.366429 0.000000\n0.000000 0.000000 6.141915\nSn Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Sn\n0.666667 0.333333 0.260183 Se\n0.333333 0.666667 0.739817 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sn",
"Se"
],
"chemical_system": "Se-Sn",
"density": 5.715265884875712,
"density_atomic": 0.0373258167784857,
"volume": 80.3733249242432,
"volume_molar": 16.133982534766965,
"formula_full": "Sn1 Se2",
"formula_reduced": "SnSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8348061444444446,
"spacegroup": 164
},
{
"id": "jvasp-20487",
"created_at": "2022-09-04T14:37:33.322664Z",
"updated_at": "2022-09-04T14:37:33.322690Z",
"structure_string": "Al1 Ir1\n1.0\n3.021741 -0.000000 0.000000\n0.000000 3.021741 -0.000000\n-0.000000 -0.000000 3.021741\nAl Ir\n1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Ir\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Al",
"Ir"
],
"chemical_system": "Al-Ir",
"density": 13.192133574320573,
"density_atomic": 0.07248669251550828,
"volume": 27.591271316070973,
"volume_molar": 8.307925980636492,
"formula_full": "Al1 Ir1",
"formula_reduced": "AlIr",
"formula_anonymous": "AB",
"energy_above_hull": 1.6215669499999996,
"spacegroup": 221
}
]
}