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=-spacegroup&page=398",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=396",
"results": [
{
"id": "jvasp-41300",
"created_at": "2022-09-04T14:37:20.253358Z",
"updated_at": "2022-09-04T14:37:20.253382Z",
"structure_string": "Na1 La1 Au2\n1.0\n-0.000000 3.642497 3.642497\n3.642497 0.000000 3.642497\n3.642497 3.642497 -0.000000\nNa La Au\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 La\n0.500001 0.500001 0.500001 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"La",
"Au"
],
"chemical_system": "Au-La-Na",
"density": 9.54909489130795,
"density_atomic": 0.0413839925678767,
"volume": 96.6557297109342,
"volume_molar": 14.551860239493996,
"formula_full": "Na1 La1 Au2",
"formula_reduced": "NaLaAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.330432285,
"spacegroup": 225
},
{
"id": "jvasp-38206",
"created_at": "2022-09-04T14:37:26.598620Z",
"updated_at": "2022-09-04T14:37:26.598646Z",
"structure_string": "Rb3 Sm1\n1.0\n0.000000 5.020370 5.020370\n5.020370 0.000000 5.020370\n5.020370 5.020370 -0.000000\nRb Sm\n3 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Rb\n0.250000 0.250000 0.250000 Rb\n0.750001 0.750001 0.750001 Sm\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Sm"
],
"chemical_system": "Rb-Sm",
"density": 2.6690320781307517,
"density_atomic": 0.015806030604536486,
"volume": 253.06796501152928,
"volume_molar": 38.10027267865461,
"formula_full": "Rb3 Sm1",
"formula_reduced": "Rb3Sm",
"formula_anonymous": "AB3",
"energy_above_hull": 0.00235,
"spacegroup": 225
},
{
"id": "jvasp-109898",
"created_at": "2022-09-04T14:37:26.913485Z",
"updated_at": "2022-09-04T14:37:26.913511Z",
"structure_string": "Rb2 Na1 Sc1 Cl6\n1.0\n6.318418 -0.000000 3.647940\n2.106139 5.957061 3.647940\n-0.000000 -0.000000 7.295880\nRb Na Sc Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.759623 0.240377 0.240377 Cl\n0.240377 0.240377 0.759623 Cl\n0.240377 0.759623 0.759623 Cl\n0.240377 0.759623 0.240377 Cl\n0.759623 0.240377 0.759623 Cl\n0.759623 0.759623 0.240377 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Na",
"Sc",
"Cl"
],
"chemical_system": "Cl-Na-Rb-Sc",
"density": 2.730764550345338,
"density_atomic": 0.036415134372378574,
"volume": 274.61109707136353,
"volume_molar": 16.53746680821775,
"formula_full": "Rb2 Na1 Sc1 Cl6",
"formula_reduced": "Rb2NaScCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109876",
"created_at": "2022-09-04T14:37:26.923034Z",
"updated_at": "2022-09-04T14:37:26.923063Z",
"structure_string": "Na2 Tl1 As1 F6\n1.0\n5.645142 -0.000000 3.259224\n1.881714 5.322291 3.259224\n-0.000000 -0.000000 6.518449\nNa Tl As F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.499999 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 As\n0.777276 0.222723 0.222723 F\n0.222723 0.222723 0.777277 F\n0.222723 0.777277 0.777277 F\n0.222723 0.777277 0.222723 F\n0.777276 0.222723 0.777276 F\n0.777276 0.777277 0.222723 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Tl",
"As",
"F"
],
"chemical_system": "As-F-Na-Tl",
"density": 3.7244974841923164,
"density_atomic": 0.05106016818763067,
"volume": 195.8473768290975,
"volume_molar": 11.794204707415878,
"formula_full": "Na2 Tl1 As1 F6",
"formula_reduced": "Na2TlAsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109439",
"created_at": "2022-09-04T14:37:26.930547Z",
"updated_at": "2022-09-04T14:37:26.930575Z",
"structure_string": "K2 Na1 Sb1 I6\n1.0\n7.409204 -0.000000 4.277706\n2.469735 6.985465 4.277706\n-0.000000 -0.000000 8.555412\nK Na Sb I\n2 1 1 6\ndirect\n0.749999 0.749999 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Sb\n0.751648 0.248352 0.248353 I\n0.248352 0.248352 0.751648 I\n0.248351 0.751648 0.751649 I\n0.248351 0.751648 0.248353 I\n0.751648 0.248352 0.751649 I\n0.751647 0.751648 0.248353 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"Sb",
"I"
],
"chemical_system": "I-K-Na-Sb",
"density": 3.6914846935692602,
"density_atomic": 0.02258354929597599,
"volume": 442.8001935808129,
"volume_molar": 26.66605094298904,
"formula_full": "K2 Na1 Sb1 I6",
"formula_reduced": "K2NaSbI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-108887",
"created_at": "2022-09-04T14:37:26.940118Z",
"updated_at": "2022-09-04T14:37:26.940140Z",
"structure_string": "Pm2 Cu1 Au1\n1.0\n4.432492 -0.000000 2.559100\n1.477497 4.178993 2.559100\n-0.000000 -0.000000 5.118201\nPm Cu Au\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750000 0.749999 0.750000 Pm\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Cu",
"Au"
],
"chemical_system": "Au-Cu-Pm",
"density": 9.642272369142942,
"density_atomic": 0.04219131387229361,
"volume": 94.80624405552676,
"volume_molar": 14.273413665732386,
"formula_full": "Pm2 Cu1 Au1",
"formula_reduced": "Pm2CuAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6576525925,
"spacegroup": 225
},
{
"id": "jvasp-38236",
"created_at": "2022-09-04T14:37:26.963327Z",
"updated_at": "2022-09-04T14:37:26.963350Z",
"structure_string": "Rb3 Li1\n1.0\n-3.570674 3.570674 5.085946\n3.570674 -3.570674 5.085946\n3.570674 3.570674 -5.085946\nRb Li\n3 1\ndirect\n0.749999 0.250000 0.499998 Rb\n0.250000 0.749999 0.499998 Rb\n0.500001 0.500001 0.000000 Rb\n0.000000 0.000000 0.000000 Li\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Li"
],
"chemical_system": "Li-Rb",
"density": 1.685935853222822,
"density_atomic": 0.015421543839849528,
"volume": 259.377403555663,
"volume_molar": 39.05018085438818,
"formula_full": "Rb3 Li1",
"formula_reduced": "Rb3Li",
"formula_anonymous": "AB3",
"energy_above_hull": 6.249999999999312e-05,
"spacegroup": 225
},
{
"id": "jvasp-37803",
"created_at": "2022-09-04T14:37:26.951348Z",
"updated_at": "2022-09-04T14:37:26.951357Z",
"structure_string": "Li2 Pm1 Ga1\n1.0\n-0.000000 3.335023 3.335023\n3.335023 0.000000 3.335023\n3.335023 3.335023 0.000000\nLi Pm Ga\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.499999 0.499999 0.499999 Li\n0.749999 0.749999 0.749999 Pm\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Pm",
"Ga"
],
"chemical_system": "Ga-Li-Pm",
"density": 5.116916459955775,
"density_atomic": 0.053917965380745836,
"volume": 74.18677562763531,
"volume_molar": 11.16908013400393,
"formula_full": "Li2 Pm1 Ga1",
"formula_reduced": "Li2PmGa",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.560918375,
"spacegroup": 225
},
{
"id": "jvasp-108908",
"created_at": "2022-09-04T14:37:27.007396Z",
"updated_at": "2022-09-04T14:37:27.007417Z",
"structure_string": "Sr2 Pr1 Ta1 O6\n1.0\n5.267019 -0.000000 3.040915\n1.755673 4.965793 3.040915\n-0.000000 -0.000000 6.081830\nSr Pr Ta O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.749999 0.749999 Sr\n0.500000 0.500000 0.499999 Pr\n0.000000 0.000000 0.000000 Ta\n0.768562 0.231438 0.231438 O\n0.231438 0.768561 0.768561 O\n0.231438 0.768561 0.231438 O\n0.768562 0.231438 0.768561 O\n0.231438 0.231438 0.768561 O\n0.768561 0.768561 0.231437 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Pr",
"Ta",
"O"
],
"chemical_system": "O-Pr-Sr-Ta",
"density": 6.191321247837352,
"density_atomic": 0.06286547864129642,
"volume": 159.06981408761573,
"volume_molar": 9.57940811102653,
"formula_full": "Sr2 Pr1 Ta1 O6",
"formula_reduced": "Sr2PrTaO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.282351267,
"spacegroup": 225
},
{
"id": "jvasp-11818",
"created_at": "2022-09-04T14:37:27.020958Z",
"updated_at": "2022-09-04T14:37:27.020980Z",
"structure_string": "Mg6 Mn1 O8\n1.0\n5.153003 0.000000 2.975087\n1.717668 4.858298 2.975087\n0.000000 0.000000 5.950176\nMg Mn O\n6 1 8\ndirect\n0.500000 -0.000000 0.000000 Mg\n0.500000 -0.000000 0.500001 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n-0.000000 -0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mn\n0.229110 0.770890 0.770890 O\n0.229110 0.770890 0.229111 O\n0.770889 0.229110 0.770891 O\n0.229110 0.229110 0.770890 O\n0.770889 0.770890 0.229111 O\n0.770889 0.229110 0.229111 O\n0.750000 0.750000 0.750001 O\n0.250000 0.250000 0.250000 O\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"O"
],
"chemical_system": "Mg-Mn-O",
"density": 3.6648651436210105,
"density_atomic": 0.10069708568972048,
"volume": 148.96160993397302,
"volume_molar": 5.9804518857239986,
"formula_full": "Mg6 Mn1 O8",
"formula_reduced": "Mg6MnO8",
"formula_anonymous": "AB6C8",
"energy_above_hull": 1.3376739694252873,
"spacegroup": 225
},
{
"id": "jvasp-41789",
"created_at": "2022-09-04T14:37:27.313034Z",
"updated_at": "2022-09-04T14:37:27.313057Z",
"structure_string": "Er2 Mg1 Al1\n1.0\n-0.000000 3.627213 3.627213\n3.627213 0.000000 3.627213\n3.627213 3.627213 0.000000\nEr Mg Al\n2 1 1\ndirect\n0.500001 0.500001 0.500001 Er\n0.000000 0.000000 0.000000 Er\n0.749998 0.749998 0.749998 Mg\n0.250000 0.250000 0.250000 Al\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Mg",
"Al"
],
"chemical_system": "Al-Er-Mg",
"density": 6.71223659534054,
"density_atomic": 0.041909339638372914,
"volume": 95.44411900820148,
"volume_molar": 14.369447984539525,
"formula_full": "Er2 Mg1 Al1",
"formula_reduced": "Er2MgAl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8221379625,
"spacegroup": 225
},
{
"id": "jvasp-40496",
"created_at": "2022-09-04T14:37:26.976935Z",
"updated_at": "2022-09-04T14:37:26.976960Z",
"structure_string": "Cu1 Sb1 Rh2\n1.0\n0.000001 3.117346 3.117346\n3.117346 0.000002 3.117346\n3.117346 3.117346 0.000001\nCu Sb Rh\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Cu\n0.750001 0.750001 0.750001 Sb\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500001 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cu",
"Sb",
"Rh"
],
"chemical_system": "Cu-Rh-Sb",
"density": 10.719414119893708,
"density_atomic": 0.0660199589555451,
"volume": 60.587738363991136,
"volume_molar": 9.12169721895017,
"formula_full": "Cu1 Sb1 Rh2",
"formula_reduced": "CuSbRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6875356375,
"spacegroup": 225
}
]
}