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_atomic&page=1230",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=1228",
"results": [
{
"id": "jvasp-15875",
"created_at": "2022-09-04T14:37:54.054011Z",
"updated_at": "2022-09-04T14:37:54.054044Z",
"structure_string": "Ce2 Sc2 Si2\n1.0\n4.083300 -0.000000 -1.072380\n-0.281635 4.073575 -1.072380\n0.032468 0.034791 8.433805\nCe Sc Si\n2 2 2\ndirect\n0.678963 0.678961 0.357923 Ce\n0.321039 0.321038 0.642077 Ce\n0.500000 0.000000 -0.000000 Sc\n0.000001 0.499999 -0.000000 Sc\n0.876268 0.876266 0.752534 Si\n0.123733 0.123733 0.247466 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Sc",
"Si"
],
"chemical_system": "Ce-Sc-Si",
"density": 5.035316168943148,
"density_atomic": 0.04267745015260182,
"volume": 140.58946770591476,
"volume_molar": 14.110826064974885,
"formula_full": "Ce2 Sc2 Si2",
"formula_reduced": "CeScSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.16463645,
"spacegroup": 139
},
{
"id": "jvasp-94424",
"created_at": "2022-09-04T14:36:00.757829Z",
"updated_at": "2022-09-04T14:36:00.757857Z",
"structure_string": "Ce2 Sc2 Si2\n1.0\n4.222056 0.000000 -0.000000\n0.000000 4.222056 -0.000000\n-2.111028 -2.111028 7.886540\nCe Sc Si\n2 2 2\ndirect\n0.678970 0.678970 0.357937 Ce\n0.321031 0.321031 0.642063 Ce\n0.500000 0.000000 0.000000 Sc\n0.000000 0.500000 0.000000 Sc\n0.876264 0.876264 0.752526 Si\n0.123737 0.123737 0.247474 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Sc",
"Si"
],
"chemical_system": "Ce-Sc-Si",
"density": 5.035528319644502,
"density_atomic": 0.042679248262328814,
"volume": 140.58354456294276,
"volume_molar": 14.1102315649629,
"formula_full": "Ce2 Sc2 Si2",
"formula_reduced": "CeScSi",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1644997833333326,
"spacegroup": 139
},
{
"id": "jvasp-110491",
"created_at": "2022-09-04T14:38:38.268574Z",
"updated_at": "2022-09-04T14:38:38.268589Z",
"structure_string": "Sm3 Mg3 Au3\n1.0\n7.664754 -0.000000 0.000000\n-3.832377 6.637872 0.000000\n0.000000 0.000000 4.144431\nSm Mg Au\n3 3 3\ndirect\n0.587978 0.000000 0.000000 Sm\n-0.000000 0.587978 0.000000 Sm\n0.412022 0.412022 0.000000 Sm\n0.244103 0.000000 0.500000 Mg\n-0.000000 0.244103 0.500000 Mg\n0.755897 0.755897 0.500000 Mg\n0.333332 0.666667 0.500000 Au\n0.666666 0.333333 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sm",
"Mg",
"Au"
],
"chemical_system": "Au-Mg-Sm",
"density": 8.77992777391876,
"density_atomic": 0.04268256414092018,
"volume": 210.85893458241455,
"volume_molar": 14.109135383988134,
"formula_full": "Sm3 Mg3 Au3",
"formula_reduced": "SmMgAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0896384983333331,
"spacegroup": 189
},
{
"id": "jvasp-120341",
"created_at": "2022-09-04T14:38:53.778302Z",
"updated_at": "2022-09-04T14:38:53.778326Z",
"structure_string": "Mg2 Se1\n1.0\n3.667543 0.728190 0.563056\n1.061696 -5.541681 0.226224\n-1.326598 -0.393408 -3.533718\nMg Se\n2 1\ndirect\n0.696521 0.425696 0.378120 Mg\n0.360913 0.857544 0.706380 Mg\n0.028710 0.141590 0.042111 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"Se"
],
"chemical_system": "Mg-Se",
"density": 3.0139064194390675,
"density_atomic": 0.04268284557874573,
"volume": 70.28584808070703,
"volume_molar": 14.109042352599785,
"formula_full": "Mg2 Se1",
"formula_reduced": "Mg2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0854200000000001,
"spacegroup": 164
},
{
"id": "jvasp-16279",
"created_at": "2022-09-04T14:37:53.858868Z",
"updated_at": "2022-09-04T14:37:53.858892Z",
"structure_string": "Tl1 S1\n1.0\n3.605153 0.000000 0.000000\n-0.000000 3.605153 0.000000\n0.000000 0.000000 3.605153\nTl S\n1 1\ndirect\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tl",
"S"
],
"chemical_system": "S-Tl",
"density": 8.379424487949553,
"density_atomic": 0.0426833889452043,
"volume": 46.856635553646925,
"volume_molar": 14.108862742204114,
"formula_full": "Tl1 S1",
"formula_reduced": "TlS",
"formula_anonymous": "AB",
"energy_above_hull": 0.5808733333333332,
"spacegroup": 221
},
{
"id": "jvasp-37773",
"created_at": "2022-09-04T14:37:58.032785Z",
"updated_at": "2022-09-04T14:37:58.032804Z",
"structure_string": "Pm2 Zn1 Pt1\n1.0\n-0.000000 3.605028 3.605028\n3.605028 0.000000 3.605028\n3.605028 3.605028 -0.000000\nPm Zn Pt\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Pm\n0.000000 0.000000 0.000000 Pm\n0.750000 0.750000 0.750000 Zn\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Zn",
"Pt"
],
"chemical_system": "Pm-Pt-Zn",
"density": 9.755397633713406,
"density_atomic": 0.042687829084326404,
"volume": 93.70352359915795,
"volume_molar": 14.107395220552775,
"formula_full": "Pm2 Zn1 Pt1",
"formula_reduced": "Pm2ZnPt",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8648535374999999,
"spacegroup": 225
},
{
"id": "jvasp-102149",
"created_at": "2022-09-04T14:36:33.146243Z",
"updated_at": "2022-09-04T14:36:33.146267Z",
"structure_string": "Rb2 O2\n1.0\n4.120408 0.000000 0.000000\n0.000000 4.076991 0.254029\n0.000000 -0.261369 5.561184\nRb O\n2 2\ndirect\n0.750000 0.749968 0.749965 Rb\n0.250000 0.250031 0.250034 Rb\n0.750000 0.750100 0.249997 O\n0.250000 0.249900 0.750003 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"O"
],
"chemical_system": "O-Rb",
"density": 3.5965624102036413,
"density_atomic": 0.04269163846810808,
"volume": 93.695162414254,
"volume_molar": 14.106136414742476,
"formula_full": "Rb2 O2",
"formula_reduced": "RbO",
"formula_anonymous": "AB",
"energy_above_hull": 0.2713383749999999,
"spacegroup": 139
},
{
"id": "jvasp-112466",
"created_at": "2022-09-04T14:38:40.324598Z",
"updated_at": "2022-09-04T14:38:40.324617Z",
"structure_string": "Ce4 N2 Cl6\n1.0\n6.191979 -0.005322 -5.397077\n-0.999488 5.531925 -5.988982\n-0.015181 0.005322 8.213940\nCe N Cl\n4 2 6\ndirect\n0.917390 0.594774 0.322617 Ce\n0.082610 0.405227 0.677383 Ce\n0.727844 0.905228 0.822617 Ce\n0.272156 0.094773 0.177383 Ce\n-0.000000 0.250000 0.250000 N\n-0.000000 0.750000 0.750000 N\n0.500000 0.250000 0.750000 Cl\n0.500000 0.750001 0.250001 Cl\n0.998831 0.804259 0.194574 Cl\n0.001169 0.195742 0.805426 Cl\n0.390316 0.695743 0.694574 Cl\n0.609684 0.304258 0.305427 Cl\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ce",
"N",
"Cl"
],
"chemical_system": "Ce-Cl-N",
"density": 4.733139662535433,
"density_atomic": 0.042691657931701835,
"volume": 281.0853590928142,
"volume_molar": 14.10612998360061,
"formula_full": "Ce4 N2 Cl6",
"formula_reduced": "Ce2NCl3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.4473860754166663,
"spacegroup": 72
},
{
"id": "jvasp-40052",
"created_at": "2022-09-04T14:37:53.429512Z",
"updated_at": "2022-09-04T14:37:53.429526Z",
"structure_string": "Th1 Sn1 Au2\n1.0\n0.000000 3.604920 3.604920\n3.604920 -0.000000 3.604920\n3.604920 3.604920 0.000000\nTh Sn Au\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Th\n0.250000 0.250000 0.250000 Sn\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"Sn",
"Au"
],
"chemical_system": "Au-Sn-Th",
"density": 13.197832022523906,
"density_atomic": 0.042691665860450936,
"volume": 93.69510229643096,
"volume_molar": 14.106127363792663,
"formula_full": "Th1 Sn1 Au2",
"formula_reduced": "ThSnAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.98908811,
"spacegroup": 225
},
{
"id": "jvasp-99100",
"created_at": "2022-09-04T14:35:41.010133Z",
"updated_at": "2022-09-04T14:35:41.010158Z",
"structure_string": "Ba2 U1 Cu2 S5\n1.0\n3.968363 -0.000036 0.923397\n1.509315 6.512257 2.501555\n-0.017898 0.012677 9.063804\nBa U Cu S\n2 1 2 5\ndirect\n0.823510 0.651109 0.701821 Ba\n0.176489 0.348892 0.298178 Ba\n0.000000 0.000000 0.000000 U\n0.445774 0.810669 0.298130 Cu\n0.554225 0.189332 0.701869 Cu\n0.612101 0.713359 0.062528 S\n0.854332 0.984111 0.307366 S\n0.387899 0.286641 0.937471 S\n0.500000 0.500000 0.500000 S\n0.145668 0.015889 0.692634 S\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"U",
"Cu",
"S"
],
"chemical_system": "Ba-Cu-S-U",
"density": 5.672049259858466,
"density_atomic": 0.042692017116119585,
"volume": 234.23582851099852,
"volume_molar": 14.106011303284543,
"formula_full": "Ba2 U1 Cu2 S5",
"formula_reduced": "Ba2UCu2S5",
"formula_anonymous": "AB2C2D5",
"energy_above_hull": 1.535926884,
"spacegroup": 12
},
{
"id": "jvasp-18844",
"created_at": "2022-09-04T14:35:55.559742Z",
"updated_at": "2022-09-04T14:35:55.559775Z",
"structure_string": "Sm2 Pd2\n1.0\n3.585756 0.000000 -1.269324\n0.000000 4.589548 -0.000000\n-0.002004 -0.000000 5.693762\nSm Pd\n2 2\ndirect\n0.137014 0.750000 0.274026 Sm\n0.862989 0.250000 0.725974 Sm\n0.412369 0.750000 0.824735 Pd\n0.587634 0.250000 0.175266 Pd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Pd"
],
"chemical_system": "Pd-Sm",
"density": 9.102159487587706,
"density_atomic": 0.04269373445997768,
"volume": 93.69056257539883,
"volume_molar": 14.105443892815996,
"formula_full": "Sm2 Pd2",
"formula_reduced": "SmPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.6139972874999997,
"spacegroup": 63
},
{
"id": "jvasp-19045",
"created_at": "2022-09-04T14:37:47.947621Z",
"updated_at": "2022-09-04T14:37:47.947646Z",
"structure_string": "Nd6 Cu6 Sb8\n1.0\n7.989464 0.000000 -2.824703\n-3.994732 6.919079 -2.824703\n-0.000000 -0.000000 8.474107\nNd Cu Sb\n6 6 8\ndirect\n0.625000 0.375000 0.250000 Nd\n0.375000 0.250000 0.625000 Nd\n0.125000 0.750000 0.875001 Nd\n0.875000 0.125000 0.750000 Nd\n0.750000 0.875000 0.125001 Nd\n0.250000 0.625000 0.375000 Nd\n0.250000 0.125000 0.875000 Cu\n0.750000 0.375000 0.625001 Cu\n0.125000 0.875000 0.250001 Cu\n0.375000 0.625000 0.750001 Cu\n0.625000 0.750000 0.375001 Cu\n0.875000 0.250000 0.125000 Cu\n0.500000 0.000000 0.338997 Sb\n0.000000 0.338997 0.500000 Sb\n0.661003 0.661004 0.661004 Sb\n0.000000 0.838997 0.500001 Sb\n0.161003 0.161003 0.161004 Sb\n0.838996 0.500000 0.000000 Sb\n0.338997 0.500000 0.000000 Sb\n0.500000 0.000000 0.838997 Sb\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"Cu",
"Sb"
],
"chemical_system": "Cu-Nd-Sb",
"density": 7.872274583978583,
"density_atomic": 0.04269432176259509,
"volume": 468.4463688452874,
"volume_molar": 14.105249858485996,
"formula_full": "Nd6 Cu6 Sb8",
"formula_reduced": "Nd3Cu3Sb4",
"formula_anonymous": "A3B3C4",
"energy_above_hull": 1.1298610250000003,
"spacegroup": 220
}
]
}