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=density&page=3477",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=3475",
"results": [
{
"id": "jvasp-86458",
"created_at": "2022-09-04T14:36:03.687841Z",
"updated_at": "2022-09-04T14:36:03.687867Z",
"structure_string": "Ho2 Ga8 Co1\n1.0\n4.222980 0.000000 0.000000\n0.000000 4.222980 -0.000000\n-0.000000 0.000000 11.079950\nHo Ga Co\n2 8 1\ndirect\n0.000000 0.000000 0.694402 Ho\n0.000000 0.000000 0.305598 Ho\n0.500000 0.000000 0.500000 Ga\n0.500000 0.000000 0.883337 Ga\n0.000000 0.500000 0.500000 Ga\n0.000000 0.500000 0.883337 Ga\n0.500000 0.500000 0.304944 Ga\n0.500000 0.500000 0.695056 Ga\n0.000000 0.500000 0.116663 Ga\n0.500000 0.000000 0.116663 Ga\n0.000000 0.000000 0.000000 Co\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Ho",
"Ga",
"Co"
],
"chemical_system": "Co-Ga-Ho",
"density": 7.954805741107663,
"density_atomic": 0.05566943778982268,
"volume": 197.59495401282797,
"volume_molar": 10.81767842300888,
"formula_full": "Ho2 Ga8 Co1",
"formula_reduced": "Ho2Ga8Co",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.2393627848484848,
"spacegroup": 123
},
{
"id": "jvasp-79681",
"created_at": "2022-09-04T14:37:14.586147Z",
"updated_at": "2022-09-04T14:37:14.586171Z",
"structure_string": "Ca1 Sb1 Pd2\n1.0\n-11.262639 3.024146 -1.564079\n-8.174352 0.776574 1.342115\n-6.790606 4.690401 -1.054605\nCa Sb Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 -0.000000 0.000001 Sb\n0.753237 0.997816 0.997817 Pd\n0.246764 0.002183 0.002183 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"Pd"
],
"chemical_system": "Ca-Pd-Sb",
"density": 7.954940306782808,
"density_atomic": 0.051143403435909084,
"volume": 78.21145507088991,
"volume_molar": 11.77500978703287,
"formula_full": "Ca1 Sb1 Pd2",
"formula_reduced": "CaSbPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9425394800000002,
"spacegroup": 225
},
{
"id": "jvasp-68772",
"created_at": "2022-09-04T14:35:51.634770Z",
"updated_at": "2022-09-04T14:35:51.634786Z",
"structure_string": "Ti1 Be2 Hg1\n1.0\n2.905282 -0.000000 0.000000\n-0.000000 2.905282 -0.000000\n0.000000 -0.000000 6.589908\nTi Be Hg\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.746643 Be\n0.000000 0.000000 0.253358 Be\n0.500000 0.500000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Hg"
],
"chemical_system": "Be-Hg-Ti",
"density": 7.955363012092127,
"density_atomic": 0.0719124446875354,
"volume": 55.62319592082122,
"volume_molar": 8.37426788390608,
"formula_full": "Ti1 Be2 Hg1",
"formula_reduced": "TiBe2Hg",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5304437833333338,
"spacegroup": 123
},
{
"id": "jvasp-16341",
"created_at": "2022-09-04T14:38:30.201514Z",
"updated_at": "2022-09-04T14:38:30.201542Z",
"structure_string": "Ba2 Sb2 Au2\n1.0\n2.827528 -4.897423 -0.000000\n2.827528 4.897423 0.000000\n0.000000 0.000000 6.874321\nBa Sb Au\n2 2 2\ndirect\n0.333333 0.666667 0.250000 Ba\n0.666667 0.333333 0.750000 Ba\n0.666667 0.333333 0.250000 Sb\n0.333333 0.666667 0.750000 Sb\n0.000000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sb",
"Au"
],
"chemical_system": "Au-Ba-Sb",
"density": 7.955374292552704,
"density_atomic": 0.031514971306886484,
"volume": 190.38570403803325,
"volume_molar": 19.10882514014561,
"formula_full": "Ba2 Sb2 Au2",
"formula_reduced": "BaSbAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3982032133333332,
"spacegroup": 194
},
{
"id": "jvasp-56691",
"created_at": "2022-09-04T14:37:04.032499Z",
"updated_at": "2022-09-04T14:37:04.032514Z",
"structure_string": "Hg4 Mo2 O8\n1.0\n4.798086 0.029777 -1.283275\n-2.550540 6.589020 -2.078526\n0.015632 0.054746 7.364609\nHg Mo O\n4 2 8\ndirect\n0.516899 0.249167 0.467944 Hg\n0.983103 0.532058 0.750834 Hg\n0.483102 0.750834 0.532057 Hg\n0.016898 0.467944 0.249166 Hg\n0.250000 0.100179 0.899822 Mo\n0.750001 0.899822 0.100179 Mo\n0.704757 0.949541 0.335162 O\n0.295244 0.050460 0.664839 O\n0.853242 0.915900 0.818367 O\n0.353242 0.818367 0.915899 O\n0.204757 0.335162 0.949541 O\n0.646759 0.181634 0.084102 O\n0.146759 0.084101 0.181633 O\n0.795244 0.664839 0.050460 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Hg",
"Mo",
"O"
],
"chemical_system": "Hg-Mo-O",
"density": 7.955395023699052,
"density_atomic": 0.05976635923641099,
"volume": 234.24548824568336,
"volume_molar": 10.07613787578879,
"formula_full": "Hg4 Mo2 O8",
"formula_reduced": "Hg2MoO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.812312728571428,
"spacegroup": 15
},
{
"id": "jvasp-116984",
"created_at": "2022-09-04T14:38:47.680640Z",
"updated_at": "2022-09-04T14:38:47.680673Z",
"structure_string": "La10 Sb2 Pb6\n1.0\n9.926041 0.000000 0.000000\n-4.963020 8.596204 0.000000\n0.000000 0.000000 7.034899\nLa Sb Pb\n10 2 6\ndirect\n0.264565 -0.000000 0.250000 La\n0.333333 0.666666 0.500000 La\n0.666667 0.333333 -0.000000 La\n0.333333 0.666666 -0.000000 La\n0.264565 0.264565 0.750000 La\n0.666667 0.333333 0.500000 La\n-0.000000 0.735435 0.750000 La\n-0.000000 0.264565 0.250000 La\n0.735435 -0.000000 0.750000 La\n0.735435 0.735435 0.250000 La\n0.000000 0.000000 0.000000 Sb\n0.000000 0.000000 0.500000 Sb\n0.388515 0.388515 0.250000 Pb\n0.611485 -0.000000 0.250000 Pb\n0.388515 -0.000000 0.750000 Pb\n-0.000000 0.611485 0.250000 Pb\n-0.000000 0.388515 0.750000 Pb\n0.611485 0.611485 0.750000 Pb\n",
"nsites": 18,
"nelements": 3,
"elements": [
"La",
"Sb",
"Pb"
],
"chemical_system": "La-Pb-Sb",
"density": 7.9554236366301625,
"density_atomic": 0.029986919952802095,
"volume": 600.2617150521326,
"volume_molar": 20.08255856046085,
"formula_full": "La10 Sb2 Pb6",
"formula_reduced": "La5SbPb3",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.4596470622222224,
"spacegroup": 193
},
{
"id": "jvasp-75767",
"created_at": "2022-09-04T14:35:46.729462Z",
"updated_at": "2022-09-04T14:35:46.729486Z",
"structure_string": "Mg1 As1 Au1\n1.0\n0.000000 3.138372 3.138372\n3.138372 0.000000 3.138372\n3.138372 3.138372 0.000000\nMg As Au\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 As\n0.750000 0.750000 0.750000 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"As",
"Au"
],
"chemical_system": "As-Au-Mg",
"density": 7.95574544448688,
"density_atomic": 0.048526391505658566,
"volume": 61.82202935180491,
"volume_molar": 12.410032094180693,
"formula_full": "Mg1 As1 Au1",
"formula_reduced": "MgAsAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.42331279,
"spacegroup": 216
},
{
"id": "jvasp-104840",
"created_at": "2022-09-04T14:36:46.132444Z",
"updated_at": "2022-09-04T14:36:46.132463Z",
"structure_string": "Ca1 Sb1 Pd2\n1.0\n4.156977 0.000000 2.400032\n1.385659 3.919235 2.400032\n-0.000000 0.000000 4.800064\nCa Sb Pd\n1 1 2\ndirect\n0.500000 0.500001 0.499999 Ca\n0.000000 0.000000 0.000000 Sb\n0.750000 0.750001 0.749998 Pd\n0.250000 0.250000 0.249999 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"Pd"
],
"chemical_system": "Ca-Pd-Sb",
"density": 7.955753827194844,
"density_atomic": 0.05114863367033343,
"volume": 78.20345751132017,
"volume_molar": 11.773805726296233,
"formula_full": "Ca1 Sb1 Pd2",
"formula_reduced": "CaSbPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.94035698,
"spacegroup": 225
},
{
"id": "jvasp-26329",
"created_at": "2022-09-04T14:38:31.221354Z",
"updated_at": "2022-09-04T14:38:31.221377Z",
"structure_string": "Sm1 Bi2 Cl1 O4\n1.0\n3.930558 0.000000 0.000000\n0.000000 3.930558 0.000000\n0.000000 -0.000000 9.021484\nSm Bi Cl O\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.282634 Bi\n0.500000 0.500000 0.717366 Bi\n0.000000 0.000000 0.500000 Cl\n0.500000 0.000000 0.841168 O\n0.000000 0.500000 0.841168 O\n0.000000 0.500000 0.158831 O\n0.500000 0.000000 0.158831 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sm",
"Bi",
"Cl",
"O"
],
"chemical_system": "Bi-Cl-O-Sm",
"density": 7.955921889019103,
"density_atomic": 0.05739890208870328,
"volume": 139.37548818681125,
"volume_molar": 10.491735104433682,
"formula_full": "Sm1 Bi2 Cl1 O4",
"formula_reduced": "SmBi2ClO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.6301006928125,
"spacegroup": 123
},
{
"id": "jvasp-100186",
"created_at": "2022-09-04T14:36:35.432313Z",
"updated_at": "2022-09-04T14:36:35.432322Z",
"structure_string": "In6 Pb2\n1.0\n6.878595 0.000000 0.000000\n-3.439296 5.957037 0.000000\n0.000000 0.000000 5.619829\nIn Pb\n6 2\ndirect\n0.165320 0.330641 0.250000 In\n0.669359 0.834680 0.250000 In\n0.165320 0.834680 0.250000 In\n0.834680 0.669359 0.750000 In\n0.330641 0.165321 0.750000 In\n0.834680 0.165321 0.750000 In\n0.333333 0.666667 0.750000 Pb\n0.666667 0.333333 0.250000 Pb\n",
"nsites": 8,
"nelements": 2,
"elements": [
"In",
"Pb"
],
"chemical_system": "In-Pb",
"density": 7.955962480486759,
"density_atomic": 0.03474056271164705,
"volume": 230.27836556366245,
"volume_molar": 17.3346091425889,
"formula_full": "In6 Pb2",
"formula_reduced": "In3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0045574999999999,
"spacegroup": 194
},
{
"id": "jvasp-111315",
"created_at": "2022-09-04T14:38:47.987993Z",
"updated_at": "2022-09-04T14:38:47.988004Z",
"structure_string": "Ba2 Lu1 U1 O6\n1.0\n5.316068 0.000000 3.069233\n1.772023 5.012037 3.069233\n-0.000000 -0.000000 6.138467\nBa Lu U O\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Ba\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 U\n0.751989 0.751990 0.248010 O\n0.248011 0.248011 0.751989 O\n0.751989 0.248011 0.751989 O\n0.248010 0.751990 0.248010 O\n0.248010 0.751990 0.751989 O\n0.751989 0.248011 0.248010 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Lu",
"U",
"O"
],
"chemical_system": "Ba-Lu-O-U",
"density": 7.956177600439137,
"density_atomic": 0.061141385886142055,
"volume": 163.55533743742862,
"volume_molar": 9.849532640974926,
"formula_full": "Ba2 Lu1 U1 O6",
"formula_reduced": "Ba2LuUO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.191490469,
"spacegroup": 225
},
{
"id": "jvasp-39022",
"created_at": "2022-09-04T14:37:58.343316Z",
"updated_at": "2022-09-04T14:37:58.343340Z",
"structure_string": "Sm3 V1\n1.0\n-0.000000 3.741780 3.741780\n3.741780 0.000000 3.741780\n3.741780 3.741780 -0.000000\nSm V\n3 1\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Sm\n0.250000 0.250000 0.250000 Sm\n0.750000 0.750000 0.750000 V\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"V"
],
"chemical_system": "Sm-V",
"density": 7.956217936717918,
"density_atomic": 0.038176424195943755,
"volume": 104.77670667817549,
"volume_molar": 15.77450189963012,
"formula_full": "Sm3 V1",
"formula_reduced": "Sm3V",
"formula_anonymous": "AB3",
"energy_above_hull": 2.35625520625,
"spacegroup": 225
}
]
}