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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4208",
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"results": [
{
"id": "jvasp-119433",
"created_at": "2022-09-04T14:38:49.641336Z",
"updated_at": "2022-09-04T14:38:49.641362Z",
"structure_string": "Tl4 Cl12\n1.0\n5.739173 -0.000000 0.000000\n0.000000 7.019576 0.000000\n-0.000000 -0.000000 10.693298\nTl Cl\n4 12\ndirect\n-0.135415 0.750000 0.188262 Tl\n0.635415 0.750000 0.688262 Tl\n0.135415 0.250000 0.811739 Tl\n0.364585 0.250000 0.311738 Tl\n0.004048 0.750000 -0.026782 Cl\n0.495952 0.750000 0.473218 Cl\n-0.004048 0.250000 0.026782 Cl\n0.504048 0.250000 0.526782 Cl\n-0.012409 0.010311 0.344057 Cl\n0.512409 0.489689 0.844057 Cl\n0.012409 0.510311 0.655943 Cl\n0.487590 -0.010311 0.155943 Cl\n0.012409 -0.010311 0.655943 Cl\n0.487590 0.510311 0.155943 Cl\n-0.012409 0.489689 0.344057 Cl\n0.512409 0.010311 0.844057 Cl\n",
"nsites": 16,
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"elements": [
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"volume": 430.79620270977216,
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"formula_full": "Tl4 Cl12",
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{
"id": "jvasp-118591",
"created_at": "2022-09-04T14:38:52.737582Z",
"updated_at": "2022-09-04T14:38:52.737597Z",
"structure_string": "La1 N1\n1.0\n4.015139 -0.000000 0.000000\n-2.007570 3.477212 -0.000000\n0.000000 0.000000 4.587705\nLa N\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.333333 0.666667 0.000000 N\n",
"nsites": 2,
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"elements": [
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"N"
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"density": 3.9642762492893673,
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"volume": 64.051195243797,
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"formula_full": "La1 N1",
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"spacegroup": 187
},
{
"id": "jvasp-123421",
"created_at": "2022-09-04T14:38:53.460984Z",
"updated_at": "2022-09-04T14:38:53.461014Z",
"structure_string": "Zr1 Pa1\n1.0\n1.593755 -2.760462 0.000000\n1.593755 2.760462 -0.000000\n0.000000 -0.000000 5.516317\nZr Pa\n1 1\ndirect\n0.333335 0.666668 0.750000 Zr\n0.666668 0.333335 0.250000 Pa\n",
"nsites": 2,
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"elements": [
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"Pa"
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"chemical_system": "Pa-Zr",
"density": 11.024852660572064,
"density_atomic": 0.04120476591946198,
"volume": 48.53807454965671,
"volume_molar": 14.615155857870318,
"formula_full": "Zr1 Pa1",
"formula_reduced": "ZrPa",
"formula_anonymous": "AB",
"energy_above_hull": 3.0231738,
"spacegroup": 187
},
{
"id": "jvasp-123688",
"created_at": "2022-09-04T14:38:52.745697Z",
"updated_at": "2022-09-04T14:38:52.745721Z",
"structure_string": "Se2 O1\n1.0\n1.838572 -3.402694 0.029554\n2.027535 3.511792 0.000000\n0.034759 -0.020068 4.408377\nSe O\n2 1\ndirect\n0.746207 0.783059 0.473363 Se\n0.253792 0.036852 0.859971 Se\n-0.000000 0.180087 0.166667 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Se",
"O"
],
"chemical_system": "O-Se",
"density": 4.905521187703391,
"density_atomic": 0.05095763745227018,
"volume": 58.87243110142166,
"volume_molar": 11.817935565872103,
"formula_full": "Se2 O1",
"formula_reduced": "Se2O",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 5
},
{
"id": "jvasp-117638",
"created_at": "2022-09-04T14:38:52.748254Z",
"updated_at": "2022-09-04T14:38:52.748281Z",
"structure_string": "Be2 Br1\n1.0\n4.365193 0.000000 0.000000\n-2.182596 3.780368 -0.000000\n-0.000000 -0.000000 3.101135\nBe Br\n2 1\ndirect\n0.333334 0.666668 0.000000 Be\n0.666667 0.333334 0.000000 Be\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"Br"
],
"chemical_system": "Be-Br",
"density": 3.1776012358129235,
"density_atomic": 0.058622327013943654,
"volume": 51.175041196956116,
"volume_molar": 10.272776716228954,
"formula_full": "Be2 Br1",
"formula_reduced": "Be2Br",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4138287683333333,
"spacegroup": 191
},
{
"id": "jvasp-118692",
"created_at": "2022-09-04T14:38:52.623139Z",
"updated_at": "2022-09-04T14:38:52.623166Z",
"structure_string": "Mg1 Cl2\n1.0\n3.925248 -0.508930 0.211705\n2.812722 -4.297548 -0.034902\n-0.844322 -3.577677 -4.648221\nMg Cl\n1 2\ndirect\n0.015099 0.147511 0.877936 Mg\n0.806581 0.751108 0.878263 Cl\n0.216266 0.796277 0.378173 Cl\n",
"nsites": 3,
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"elements": [
"Mg",
"Cl"
],
"chemical_system": "Cl-Mg",
"density": 2.313014676467377,
"density_atomic": 0.04388978153715244,
"volume": 68.3530401594849,
"volume_molar": 13.721054307145033,
"formula_full": "Mg1 Cl2",
"formula_reduced": "MgCl2",
"formula_anonymous": "AB2",
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"spacegroup": 38
},
{
"id": "jvasp-118132",
"created_at": "2022-09-04T14:38:52.700314Z",
"updated_at": "2022-09-04T14:38:52.700330Z",
"structure_string": "P1 Cl2\n1.0\n4.744999 -0.000000 0.000000\n-2.372500 4.109290 0.000000\n0.000000 0.000000 3.150925\nP Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 P\n0.333334 0.666667 0.000000 Cl\n0.666667 0.333334 0.000000 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"P",
"Cl"
],
"chemical_system": "Cl-P",
"density": 2.753569462987917,
"density_atomic": 0.048829274564701174,
"volume": 61.438553546906654,
"volume_molar": 12.333053918342305,
"formula_full": "P1 Cl2",
"formula_reduced": "PCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.057684545,
"spacegroup": 191
},
{
"id": "jvasp-118693",
"created_at": "2022-09-04T14:38:52.624349Z",
"updated_at": "2022-09-04T14:38:52.624364Z",
"structure_string": "Mg1 Cl1\n1.0\n3.849429 0.000000 0.000000\n0.000000 3.849429 0.000000\n-0.000000 0.000000 3.402710\nMg Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"Cl"
],
"chemical_system": "Cl-Mg",
"density": 1.9680112940163563,
"density_atomic": 0.039665454111355525,
"volume": 50.42170938936597,
"volume_molar": 15.182331565128777,
"formula_full": "Mg1 Cl1",
"formula_reduced": "MgCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.21078,
"spacegroup": 123
},
{
"id": "jvasp-121063",
"created_at": "2022-09-04T14:38:52.777100Z",
"updated_at": "2022-09-04T14:38:52.777119Z",
"structure_string": "Ge1 O1\n1.0\n5.291772 0.000000 0.000000\n0.000000 5.291772 0.000000\n0.000000 0.000000 7.408481\nGe O\n1 1\ndirect\n0.000000 0.000000 0.830659 Ge\n0.000000 0.000000 0.169341 O\n",
"nsites": 2,
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"elements": [
"Ge",
"O"
],
"chemical_system": "Ge-O",
"density": 0.7094870709578692,
"density_atomic": 0.009640478185062007,
"volume": 207.45858883836436,
"volume_molar": 62.46724119277975,
"formula_full": "Ge1 O1",
"formula_reduced": "GeO",
"formula_anonymous": "AB",
"energy_above_hull": 2.022364725,
"spacegroup": 99
},
{
"id": "jvasp-123692",
"created_at": "2022-09-04T14:38:52.871000Z",
"updated_at": "2022-09-04T14:38:52.871016Z",
"structure_string": "Pb1 Se2\n1.0\n2.397684 -3.996667 -0.897470\n2.262376 3.918547 -0.000001\n-1.161625 0.670664 5.756253\nPb Se\n1 2\ndirect\n0.000000 0.333365 0.166667 Pb\n0.811598 0.739117 0.444196 Se\n0.188403 -0.072481 0.889137 Se\n",
"nsites": 3,
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"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 6.021804947402711,
"density_atomic": 0.029796360403474727,
"volume": 100.68343782182714,
"volume_molar": 20.210994492125028,
"formula_full": "Pb1 Se2",
"formula_reduced": "PbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 12
},
{
"id": "jvasp-117840",
"created_at": "2022-09-04T14:38:52.973321Z",
"updated_at": "2022-09-04T14:38:52.973351Z",
"structure_string": "P1 Br2\n1.0\n8.262770 0.000000 -5.268526\n0.000000 2.795434 0.000000\n-5.146147 0.000000 6.781929\nP Br\n1 2\ndirect\n0.075733 0.000000 0.404819 P\n-0.074320 0.000000 -0.048344 Br\n0.225681 0.000000 -0.142110 Br\n",
"nsites": 3,
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"elements": [
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"chemical_system": "Br-P",
"density": 3.91800233386243,
"density_atomic": 0.037102228189949175,
"volume": 80.85767745918523,
"volume_molar": 16.231210506196422,
"formula_full": "P1 Br2",
"formula_reduced": "PBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.91577457,
"spacegroup": 65
},
{
"id": "jvasp-123548",
"created_at": "2022-09-04T14:38:51.738185Z",
"updated_at": "2022-09-04T14:38:51.738195Z",
"structure_string": "Ac1 P3\n1.0\n3.723553 -0.000000 -1.192328\n-0.044129 4.373273 -0.137811\n-0.145184 -0.196293 5.956954\nAc P\n1 3\ndirect\n0.340512 -0.012932 0.681023 Ac\n0.622142 0.091144 0.244284 P\n0.113970 0.423673 0.227939 P\n0.923376 0.498116 0.846752 P\n",
"nsites": 4,
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"elements": [
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"density": 5.5259622484251,
"density_atomic": 0.04160788789272652,
"volume": 96.13561760964176,
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"formula_full": "Ac1 P3",
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"formula_anonymous": "AB3",
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"spacegroup": 8
}
]
}