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=elements&page=198",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=196",
"results": [
{
"id": "jvasp-8194",
"created_at": "2022-09-04T14:37:50.392661Z",
"updated_at": "2022-09-04T14:37:50.392683Z",
"structure_string": "Ca2 P6\n1.0\n5.604255 -0.010142 0.001294\n1.478251 5.427305 -0.006113\n1.022475 1.720260 5.320786\nCa P\n2 6\ndirect\n0.676897 0.642805 0.645037 Ca\n0.323102 0.357196 0.354964 Ca\n0.597565 0.797266 0.100485 P\n0.402434 0.202735 0.899516 P\n0.002887 0.202197 0.997434 P\n0.997112 0.797804 0.002567 P\n0.129485 0.821178 0.603549 P\n0.870514 0.178824 0.396452 P\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ca",
"P"
],
"chemical_system": "Ca-P",
"density": 2.727022327118685,
"density_atomic": 0.049391279635130535,
"volume": 161.9719120277629,
"volume_molar": 12.192720667469066,
"formula_full": "Ca2 P6",
"formula_reduced": "CaP3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.93963673,
"spacegroup": 2
},
{
"id": "jvasp-36464",
"created_at": "2022-09-04T14:37:29.325548Z",
"updated_at": "2022-09-04T14:37:29.325576Z",
"structure_string": "Ca3 P2\n1.0\n5.283328 -0.000000 0.000000\n0.000000 5.283328 0.000000\n0.000000 -0.000000 5.283328\nCa P\n3 2\ndirect\n0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.000000 0.000000 0.000000 P\n0.500000 0.500000 0.500000 P\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ca",
"P"
],
"chemical_system": "Ca-P",
"density": 2.051307216739777,
"density_atomic": 0.033903714641995715,
"volume": 147.4764654197101,
"volume_molar": 17.762480670895336,
"formula_full": "Ca3 P2",
"formula_reduced": "Ca3P2",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.8198604520000001,
"spacegroup": 221
},
{
"id": "jvasp-17747",
"created_at": "2022-09-04T14:37:31.312111Z",
"updated_at": "2022-09-04T14:37:31.312139Z",
"structure_string": "Ca1 Pb3\n1.0\n4.922419 0.000000 -0.000000\n0.000000 4.922419 0.000000\n0.000000 0.000000 4.922419\nCa Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n0.500000 0.000000 0.500000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Pb"
],
"chemical_system": "Ca-Pb",
"density": 9.212129985480429,
"density_atomic": 0.03353700349182018,
"volume": 119.27124022799525,
"volume_molar": 17.95670493181905,
"formula_full": "Ca1 Pb3",
"formula_reduced": "CaPb3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.16635791,
"spacegroup": 221
},
{
"id": "jvasp-18643",
"created_at": "2022-09-04T14:36:56.075641Z",
"updated_at": "2022-09-04T14:36:56.075661Z",
"structure_string": "Ca3 Pb1\n1.0\n5.002171 -0.000000 -0.000000\n-0.000000 5.002171 -0.000000\n0.000000 0.000000 5.002171\nCa Pb\n3 1\ndirect\n0.000000 0.500000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Pb"
],
"chemical_system": "Ca-Pb",
"density": 4.344074541051629,
"density_atomic": 0.03195835297151288,
"volume": 125.16289570884742,
"volume_molar": 18.843714397196976,
"formula_full": "Ca3 Pb1",
"formula_reduced": "Ca3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 1.2500000000002093e-05,
"spacegroup": 221
},
{
"id": "jvasp-13112",
"created_at": "2022-09-04T14:37:07.375093Z",
"updated_at": "2022-09-04T14:37:07.375121Z",
"structure_string": "Ca8 Pb4\n1.0\n5.144765 0.000000 0.000000\n0.000000 7.755039 0.000000\n0.000000 0.000000 9.564276\nCa Pb\n8 4\ndirect\n0.749999 0.334161 0.072517 Ca\n0.250000 0.665839 0.927483 Ca\n0.749999 0.834162 0.427483 Ca\n0.250000 0.165839 0.572517 Ca\n0.749999 0.479843 0.691833 Ca\n0.250000 0.520157 0.308168 Ca\n0.749999 0.979843 0.808168 Ca\n0.250000 0.020157 0.191832 Ca\n0.749999 0.753907 0.104392 Pb\n0.250000 0.246093 0.895608 Pb\n0.749999 0.253907 0.395608 Pb\n0.250000 0.746093 0.604392 Pb\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ca",
"Pb"
],
"chemical_system": "Ca-Pb",
"density": 5.001816212740626,
"density_atomic": 0.03144702873701981,
"volume": 381.5940800115548,
"volume_molar": 19.15011052510238,
"formula_full": "Ca8 Pb4",
"formula_reduced": "Ca2Pb",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-36396",
"created_at": "2022-09-04T14:36:43.343183Z",
"updated_at": "2022-09-04T14:36:43.343203Z",
"structure_string": "Ca2 Pb1\n1.0\n3.777171 3.777171 -0.000000\n3.777171 -0.000000 -3.777171\n0.000000 3.777171 -3.777171\nCa Pb\n2 1\ndirect\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750000 0.750000 Ca\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"Pb"
],
"chemical_system": "Ca-Pb",
"density": 4.4273048946931794,
"density_atomic": 0.027835005991689477,
"volume": 107.77795416662354,
"volume_molar": 21.63513369387452,
"formula_full": "Ca2 Pb1",
"formula_reduced": "Ca2Pb",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0123999999999999,
"spacegroup": 225
},
{
"id": "jvasp-79216",
"created_at": "2022-09-04T14:37:12.884640Z",
"updated_at": "2022-09-04T14:37:12.884662Z",
"structure_string": "Ca3 Pb1\n1.0\n5.002195 0.000000 0.000000\n-0.000000 5.002195 0.000000\n-0.000000 -0.000000 5.002195\nCa Pb\n3 1\ndirect\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Pb"
],
"chemical_system": "Ca-Pb",
"density": 4.344012014127686,
"density_atomic": 0.03195789297537636,
"volume": 125.1646972809506,
"volume_molar": 18.843985630216846,
"formula_full": "Ca3 Pb1",
"formula_reduced": "Ca3Pb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-17586",
"created_at": "2022-09-04T14:38:30.516988Z",
"updated_at": "2022-09-04T14:38:30.517015Z",
"structure_string": "Ca2 Pb2\n1.0\n4.563205 0.000000 0.000000\n0.000000 5.065384 0.000000\n0.000000 0.000000 5.065384\nCa Pb\n2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.500000 Ca\n0.500001 0.000000 0.500000 Pb\n0.500001 0.500000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Pb"
],
"chemical_system": "Ca-Pb",
"density": 7.014065940362039,
"density_atomic": 0.03416372860293201,
"volume": 117.08323896639054,
"volume_molar": 17.627293642308018,
"formula_full": "Ca2 Pb2",
"formula_reduced": "CaPb",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-14862",
"created_at": "2022-09-04T14:35:58.661651Z",
"updated_at": "2022-09-04T14:35:58.661666Z",
"structure_string": "Ca1 Pd1\n1.0\n3.508722 -0.000000 0.000000\n-0.000000 3.508722 -0.000000\n0.000000 -0.000000 3.508722\nCa Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ca",
"Pd"
],
"chemical_system": "Ca-Pd",
"density": 5.631627401245475,
"density_atomic": 0.04630022652854423,
"volume": 43.19633293299319,
"volume_molar": 13.006719861915432,
"formula_full": "Ca1 Pd1",
"formula_reduced": "CaPd",
"formula_anonymous": "AB",
"energy_above_hull": 0.02052806,
"spacegroup": 221
},
{
"id": "jvasp-78527",
"created_at": "2022-09-04T14:37:09.396738Z",
"updated_at": "2022-09-04T14:37:09.396758Z",
"structure_string": "Ca1 Pd2\n1.0\n3.816298 0.000000 0.000000\n0.000000 3.816298 0.000000\n-1.908147 -1.908147 4.525492\nCa Pd\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"Pd"
],
"chemical_system": "Ca-Pd",
"density": 6.372039735641777,
"density_atomic": 0.045516713199071204,
"volume": 65.90985572440711,
"volume_molar": 13.230614288122378,
"formula_full": "Ca1 Pd2",
"formula_reduced": "CaPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.7013139399999998,
"spacegroup": 139
},
{
"id": "jvasp-19856",
"created_at": "2022-09-04T14:37:02.066556Z",
"updated_at": "2022-09-04T14:37:02.066584Z",
"structure_string": "Ca2 Pd4\n1.0\n4.716196 -0.000000 2.722898\n1.572066 4.446473 2.722898\n-0.000000 -0.000000 5.445795\nCa Pd\n2 4\ndirect\n0.875002 0.874999 0.875001 Ca\n0.125000 0.125000 0.125000 Ca\n0.500001 0.500000 0.500001 Pd\n0.500001 0.500000 0.000000 Pd\n0.000001 0.500000 0.500001 Pd\n0.500000 0.000000 0.500000 Pd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Pd"
],
"chemical_system": "Ca-Pd",
"density": 7.3551246628220595,
"density_atomic": 0.05253907911912427,
"volume": 114.20070737052555,
"volume_molar": 11.462212244614573,
"formula_full": "Ca2 Pd4",
"formula_reduced": "CaPd2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6019139399999999,
"spacegroup": 227
},
{
"id": "jvasp-4765",
"created_at": "2022-09-04T14:36:35.089139Z",
"updated_at": "2022-09-04T14:36:35.089165Z",
"structure_string": "Ca1 Pd5\n1.0\n2.661303 -4.609513 0.000000\n2.661303 4.609513 0.000000\n0.000000 0.000000 4.460502\nCa Pd\n1 5\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333333 0.666666 0.000000 Pd\n0.666666 0.333333 0.000000 Pd\n-0.000000 0.500000 0.500000 Pd\n0.499999 0.499999 0.500000 Pd\n0.500000 -0.000000 0.500000 Pd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Pd"
],
"chemical_system": "Ca-Pd",
"density": 8.681947414717078,
"density_atomic": 0.05482620032970077,
"volume": 109.43672849693442,
"volume_molar": 10.984056388707371,
"formula_full": "Ca1 Pd5",
"formula_reduced": "CaPd5",
"formula_anonymous": "AB5",
"energy_above_hull": 1.3931731533333336,
"spacegroup": 191
}
]
}