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=-formula_anonymous&page=3583",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3581",
"results": [
{
"id": "jvasp-86510",
"created_at": "2022-09-04T14:36:10.945795Z",
"updated_at": "2022-09-04T14:36:10.945823Z",
"structure_string": "Lu1 Si2 Cu2\n1.0\n3.694904 -0.000000 -1.344150\n-0.488982 3.662405 -1.344150\n-0.007891 -0.009014 5.728803\nLu Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Lu\n0.615870 0.615870 0.231739 Si\n0.384130 0.384130 0.768260 Si\n0.250000 0.750000 0.500000 Cu\n0.750000 0.250000 0.500000 Cu\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Lu",
"Si",
"Cu"
],
"chemical_system": "Cu-Lu-Si",
"density": 7.682092450722734,
"density_atomic": 0.06457114435638144,
"volume": 77.43396914888129,
"volume_molar": 9.32636523640121,
"formula_full": "Lu1 Si2 Cu2",
"formula_reduced": "Lu(CuSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.33968477,
"spacegroup": 139
},
{
"id": "jvasp-100054",
"created_at": "2022-09-04T14:36:21.935800Z",
"updated_at": "2022-09-04T14:36:21.935833Z",
"structure_string": "Ca2 Pd1 N2\n1.0\n3.417370 0.000000 -0.919687\n-0.247468 3.408396 -0.919538\n0.003538 0.004249 6.822115\nCa Pd N\n2 1 2\ndirect\n0.155383 0.155383 0.810766 Ca\n0.844617 0.844618 0.189234 Ca\n0.500000 0.500001 0.500000 Pd\n0.652930 0.652919 0.805860 N\n0.347070 0.347083 0.194140 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Pd",
"N"
],
"chemical_system": "Ca-N-Pd",
"density": 4.482883224066101,
"density_atomic": 0.0629028129891274,
"volume": 79.48770114405278,
"volume_molar": 9.573722499565976,
"formula_full": "Ca2 Pd1 N2",
"formula_reduced": "Ca2PdN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.216574608,
"spacegroup": 139
},
{
"id": "jvasp-97797",
"created_at": "2022-09-04T14:36:10.856258Z",
"updated_at": "2022-09-04T14:36:10.856283Z",
"structure_string": "Nd4 In2 Ge4\n1.0\n4.322433 0.000000 0.000000\n0.000000 7.606380 0.000000\n-0.000000 0.000000 7.606380\nNd In Ge\n4 2 4\ndirect\n0.500000 0.819883 0.319883 Nd\n0.500000 0.680117 0.819883 Nd\n0.500000 0.319883 0.180117 Nd\n0.500000 0.180117 0.680117 Nd\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 In\n0.000000 0.118325 0.381675 Ge\n0.000000 0.381675 0.881675 Ge\n0.000000 0.618325 0.118325 Ge\n0.000000 0.881675 0.618325 Ge\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Nd",
"In",
"Ge"
],
"chemical_system": "Ge-In-Nd",
"density": 7.285113798836944,
"density_atomic": 0.039986711890269484,
"volume": 250.0830782846498,
"volume_molar": 15.060354991242603,
"formula_full": "Nd4 In2 Ge4",
"formula_reduced": "Nd2InGe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7800589739999999,
"spacegroup": 127
},
{
"id": "jvasp-89624",
"created_at": "2022-09-04T14:36:10.841829Z",
"updated_at": "2022-09-04T14:36:10.841856Z",
"structure_string": "Sr4 H8 O8\n1.0\n9.881477 0.000000 0.000000\n0.000000 6.041737 0.000000\n0.000000 0.000000 3.912510\nSr H O\n4 8 8\ndirect\n0.658084 0.397896 0.250000 Sr\n0.158084 0.102104 0.250000 Sr\n0.338685 0.602125 0.750000 Sr\n0.838685 0.897876 0.750000 Sr\n0.523761 0.128443 0.750000 H\n0.023761 0.371557 0.750000 H\n0.972994 0.628503 0.250000 H\n0.472994 0.871498 0.250000 H\n0.090412 0.684044 0.750000 H\n0.406362 0.184078 0.250000 H\n0.906363 0.315922 0.250000 H\n0.590412 0.815957 0.750000 H\n0.122714 0.373912 0.750000 O\n0.892325 0.154038 0.250000 O\n0.392325 0.345962 0.250000 O\n0.104434 0.845930 0.750000 O\n0.604434 0.654071 0.750000 O\n0.874041 0.626055 0.250000 O\n0.374041 0.873946 0.250000 O\n0.622714 0.126088 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Sr",
"H",
"O"
],
"chemical_system": "H-O-Sr",
"density": 3.4588152469480864,
"density_atomic": 0.08562308170315305,
"volume": 233.58187537956255,
"volume_molar": 7.033314662602521,
"formula_full": "Sr4 H8 O8",
"formula_reduced": "Sr(HO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.613674662,
"spacegroup": 62
},
{
"id": "jvasp-92783",
"created_at": "2022-09-04T14:36:21.751667Z",
"updated_at": "2022-09-04T14:36:21.751688Z",
"structure_string": "Tb1 Ge2 Ru2\n1.0\n3.967406 -0.000000 -1.563419\n-0.616090 3.919279 -1.563419\n-0.011518 -0.013469 5.786420\nTb Ge Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.370208 0.370208 0.740415 Ge\n0.629793 0.629793 0.259585 Ge\n0.250000 0.750000 0.500000 Ru\n0.750000 0.250000 0.500000 Ru\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Ge",
"Ru"
],
"chemical_system": "Ge-Ru-Tb",
"density": 9.362254179664175,
"density_atomic": 0.055674267098848644,
"volume": 89.80809735892151,
"volume_molar": 10.816740073664192,
"formula_full": "Tb1 Ge2 Ru2",
"formula_reduced": "Tb(GeRu)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.4386222600000003,
"spacegroup": 139
},
{
"id": "jvasp-92645",
"created_at": "2022-09-04T14:36:21.770153Z",
"updated_at": "2022-09-04T14:36:21.770177Z",
"structure_string": "U2 Ru1 C2\n1.0\n3.441873 0.000000 0.000000\n0.000000 3.441873 0.000000\n-1.720936 -1.720936 6.283897\nU Ru C\n2 1 2\ndirect\n0.644806 0.644806 0.289616 U\n0.355192 0.355192 0.710385 U\n0.000000 0.000000 0.000000 Ru\n0.828023 0.828023 0.656050 C\n0.171975 0.171975 0.343951 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"U",
"Ru",
"C"
],
"chemical_system": "C-Ru-U",
"density": 13.409501852486477,
"density_atomic": 0.06716627504320904,
"volume": 74.44212138879858,
"volume_molar": 8.966018669527035,
"formula_full": "U2 Ru1 C2",
"formula_reduced": "U2RuC2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 6.0048505,
"spacegroup": 139
},
{
"id": "jvasp-98223",
"created_at": "2022-09-04T14:36:08.638299Z",
"updated_at": "2022-09-04T14:36:08.638327Z",
"structure_string": "Hg4 P2 Cl4\n1.0\n5.609505 -0.031704 2.020616\n-0.198053 5.606097 2.020616\n-0.023776 -0.024492 7.781881\nHg P Cl\n4 2 4\ndirect\n0.500000 0.000000 0.000000 Hg\n0.000000 0.500000 0.000000 Hg\n0.287446 0.287447 0.430060 Hg\n0.712553 0.712554 0.569941 Hg\n0.359627 0.359627 0.086705 P\n0.640372 0.640374 0.913296 P\n0.273115 0.726886 0.500000 Cl\n0.726884 0.273116 0.500000 Cl\n0.894631 0.894632 0.216915 Cl\n0.105368 0.105369 0.783086 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Hg",
"P",
"Cl"
],
"chemical_system": "Cl-Hg-P",
"density": 6.81280364655865,
"density_atomic": 0.04077811986083252,
"volume": 245.22955040909142,
"volume_molar": 14.768068710750644,
"formula_full": "Hg4 P2 Cl4",
"formula_reduced": "Hg2PCl2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-92406",
"created_at": "2022-09-04T14:36:21.817719Z",
"updated_at": "2022-09-04T14:36:21.817750Z",
"structure_string": "Y1 Ni2 P2\n1.0\n3.636497 0.000000 -1.389646\n-0.531038 3.597515 -1.389646\n0.002995 0.003469 5.460743\nY Ni P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.750000 0.250000 0.499999 Ni\n0.249999 0.750001 0.499999 Ni\n0.376459 0.376461 0.752918 P\n0.623540 0.623541 0.247080 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"Ni",
"P"
],
"chemical_system": "Ni-P-Y",
"density": 6.231925184055333,
"density_atomic": 0.06995508934679473,
"volume": 71.4744280464434,
"volume_molar": 8.60858132872348,
"formula_full": "Y1 Ni2 P2",
"formula_reduced": "Y(NiP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.12626025,
"spacegroup": 139
},
{
"id": "jvasp-92716",
"created_at": "2022-09-04T14:36:10.885747Z",
"updated_at": "2022-09-04T14:36:10.885767Z",
"structure_string": "Rb2 Te2 Pd1\n1.0\n0.000000 0.000000 4.067807\n-5.336376 4.040892 2.033904\n-5.336376 -4.040892 2.033904\nRb Te Pd\n2 2 1\ndirect\n0.200157 0.299843 0.299843 Rb\n0.799842 0.700158 0.700158 Rb\n0.499999 0.217998 0.782003 Te\n0.499999 0.782003 0.217998 Te\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Te",
"Pd"
],
"chemical_system": "Pd-Rb-Te",
"density": 5.040806802368934,
"density_atomic": 0.028500731302348307,
"volume": 175.43409489945358,
"volume_molar": 21.12977627175415,
"formula_full": "Rb2 Te2 Pd1",
"formula_reduced": "Rb2Te2Pd",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.1737962466666666,
"spacegroup": 71
},
{
"id": "jvasp-92628",
"created_at": "2022-09-04T14:36:21.954713Z",
"updated_at": "2022-09-04T14:36:21.954729Z",
"structure_string": "Ca1 Fe2 As2\n1.0\n3.972816 0.000000 -0.000000\n0.000000 3.972816 0.000000\n-1.986408 -1.986408 5.247653\nCa Fe As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.250000 0.750000 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.637905 0.637905 0.275808 As\n0.362096 0.362096 0.724191 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Fe",
"As"
],
"chemical_system": "As-Ca-Fe",
"density": 6.046924550061747,
"density_atomic": 0.060368167392583404,
"volume": 82.82510826416573,
"volume_molar": 9.975689208580905,
"formula_full": "Ca1 Fe2 As2",
"formula_reduced": "Ca(FeAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.243208984,
"spacegroup": 139
},
{
"id": "jvasp-92585",
"created_at": "2022-09-04T14:36:21.978649Z",
"updated_at": "2022-09-04T14:36:21.978665Z",
"structure_string": "Sr1 Co2 Si2\n1.0\n3.958704 -0.000000 0.000000\n0.000000 3.958704 0.000000\n-1.979352 -1.979352 5.345828\nSr Co Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.750000 0.500000 Co\n0.750000 0.250000 0.500000 Co\n0.645280 0.645280 0.290563 Si\n0.354719 0.354719 0.709438 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Co",
"Si"
],
"chemical_system": "Co-Si-Sr",
"density": 5.186340918874401,
"density_atomic": 0.059682768855874466,
"volume": 83.77627405448129,
"volume_molar": 10.090250294088445,
"formula_full": "Sr1 Co2 Si2",
"formula_reduced": "Sr(CoSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.503821062,
"spacegroup": 139
},
{
"id": "jvasp-22731",
"created_at": "2022-09-04T14:36:10.458060Z",
"updated_at": "2022-09-04T14:36:10.458088Z",
"structure_string": "Sr1 Mg2 As2\n1.0\n4.420559 -0.000004 -0.000000\n-2.210284 3.828317 0.000001\n-0.000000 0.000000 7.405534\nSr Mg As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666668 0.333334 0.370908 Mg\n0.333334 0.666668 0.629091 Mg\n0.333336 0.666668 0.260752 As\n0.666668 0.333334 0.739247 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Mg",
"As"
],
"chemical_system": "As-Mg-Sr",
"density": 3.7903999258221788,
"density_atomic": 0.03989594603388749,
"volume": 125.32601672743932,
"volume_molar": 15.094618272455085,
"formula_full": "Sr1 Mg2 As2",
"formula_reduced": "Sr(MgAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.2927735819999998,
"spacegroup": 164
}
]
}