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=energy_above_hull&page=1069",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=1067",
"results": [
{
"id": "jvasp-19725",
"created_at": "2022-09-04T14:38:29.603934Z",
"updated_at": "2022-09-04T14:38:29.603961Z",
"structure_string": "Sc1 S1\n1.0\n3.192992 -0.000000 1.843475\n1.064331 3.010382 1.843475\n-0.000000 -0.000000 3.686950\nSc S\n1 1\ndirect\n0.500000 0.500000 0.500002 Sc\n0.000000 0.000000 0.000000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"S"
],
"chemical_system": "S-Sc",
"density": 3.6088685808337564,
"density_atomic": 0.05643432159212246,
"volume": 35.439426639252375,
"volume_molar": 10.671060783763576,
"formula_full": "Sc1 S1",
"formula_reduced": "ScS",
"formula_anonymous": "AB",
"energy_above_hull": 0.480037625,
"spacegroup": 225
},
{
"id": "jvasp-97423",
"created_at": "2022-09-04T14:36:14.681863Z",
"updated_at": "2022-09-04T14:36:14.681889Z",
"structure_string": "K32 Ge8 S32\n1.0\n12.737073 -0.000000 0.000000\n-0.000000 12.737073 0.000000\n0.000000 0.000000 12.737073\nK Ge S\n32 8 32\ndirect\n0.365078 0.151013 0.413438 K\n0.847989 0.847989 0.152010 K\n0.586562 0.634922 0.151013 K\n0.086562 0.651013 0.134922 K\n0.586562 0.365078 0.848986 K\n0.913438 0.651013 0.865078 K\n0.347990 0.652010 0.347990 K\n0.865078 0.913438 0.651013 K\n0.134922 0.913438 0.348986 K\n0.365078 0.848986 0.586562 K\n0.413438 0.634922 0.848986 K\n0.086562 0.348986 0.865078 K\n0.348986 0.134922 0.913438 K\n0.348986 0.865078 0.086562 K\n0.634922 0.151013 0.586562 K\n0.152010 0.152010 0.152010 K\n0.347990 0.347990 0.652010 K\n0.865078 0.086562 0.348986 K\n0.134922 0.086562 0.651013 K\n0.651013 0.865078 0.913438 K\n0.652010 0.347990 0.347990 K\n0.848986 0.413438 0.634922 K\n0.847989 0.152010 0.847989 K\n0.651013 0.134922 0.086562 K\n0.848986 0.586562 0.365078 K\n0.413438 0.365078 0.151013 K\n0.151013 0.413438 0.365078 K\n0.634922 0.848986 0.413438 K\n0.152010 0.847989 0.847989 K\n0.652010 0.652010 0.652010 K\n0.913438 0.348986 0.134922 K\n0.151013 0.586562 0.634922 K\n0.000000 0.000000 0.000000 Ge\n0.750000 0.500000 0.000000 Ge\n0.500000 0.500000 0.500000 Ge\n0.000000 0.250000 0.500000 Ge\n0.250000 0.500000 0.000000 Ge\n0.500000 0.000000 0.750000 Ge\n0.500000 0.000000 0.250000 Ge\n0.000000 0.750000 0.500000 Ge\n0.402475 0.111696 0.153802 S\n0.398279 0.398279 0.398279 S\n0.597524 0.111696 0.846197 S\n0.888304 0.153802 0.597524 S\n0.398279 0.601721 0.601721 S\n0.653802 0.611695 0.902475 S\n0.902475 0.653802 0.611695 S\n0.611695 0.097525 0.346198 S\n0.101721 0.101721 0.898278 S\n0.846197 0.402475 0.888304 S\n0.388304 0.902475 0.346198 S\n0.097525 0.346198 0.611695 S\n0.402475 0.888304 0.846197 S\n0.101721 0.898278 0.101721 S\n0.902475 0.346198 0.388304 S\n0.153802 0.402475 0.111696 S\n0.611695 0.902475 0.653802 S\n0.597524 0.888304 0.153802 S\n0.111696 0.846197 0.597524 S\n0.888304 0.846197 0.402475 S\n0.346198 0.388304 0.902475 S\n0.097525 0.653802 0.388304 S\n0.111696 0.153802 0.402475 S\n0.346198 0.611695 0.097525 S\n0.601721 0.398279 0.601721 S\n0.898278 0.898278 0.898278 S\n0.653802 0.388304 0.097525 S\n0.388304 0.097525 0.653802 S\n0.898278 0.101721 0.101721 S\n0.846197 0.597524 0.111696 S\n0.153802 0.597524 0.888304 S\n0.601721 0.601721 0.398279 S\n",
"nsites": 72,
"nelements": 3,
"elements": [
"K",
"Ge",
"S"
],
"chemical_system": "Ge-K-S",
"density": 2.296967876651079,
"density_atomic": 0.03484364519463076,
"volume": 2066.373928382638,
"volume_molar": 17.28332591599223,
"formula_full": "K32 Ge8 S32",
"formula_reduced": "K4GeS4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 0.4800719944444443,
"spacegroup": 218
},
{
"id": "jvasp-103291",
"created_at": "2022-09-04T14:36:34.592462Z",
"updated_at": "2022-09-04T14:36:34.592479Z",
"structure_string": "Pm2 Ga1 Cu1\n1.0\n4.422756 0.000000 2.553479\n1.474252 4.169814 2.553479\n-0.000000 -0.000000 5.106958\nPm Ga Cu\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pm\n0.750001 0.749999 0.750000 Pm\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Ga",
"Cu"
],
"chemical_system": "Cu-Ga-Pm",
"density": 7.462659216142397,
"density_atomic": 0.04247056529918467,
"volume": 94.1828763479348,
"volume_molar": 14.17956346372345,
"formula_full": "Pm2 Ga1 Cu1",
"formula_reduced": "Pm2GaCu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4806332312499999,
"spacegroup": 225
},
{
"id": "jvasp-77477",
"created_at": "2022-09-04T14:37:11.738663Z",
"updated_at": "2022-09-04T14:37:11.738700Z",
"structure_string": "Cd1 Sn1 Pd2\n1.0\n-9.235036 -0.000000 -5.331850\n-6.081291 0.213845 -0.130596\n-5.206250 2.688835 -1.646212\nCd Sn Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 -0.000000 Sn\n0.746784 0.000001 -0.000000 Pd\n0.253216 0.000000 -0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cd",
"Sn",
"Pd"
],
"chemical_system": "Cd-Pd-Sn",
"density": 9.072711355327101,
"density_atomic": 0.049226977032227254,
"volume": 81.25625909105355,
"volume_molar": 12.233415746933854,
"formula_full": "Cd1 Sn1 Pd2",
"formula_reduced": "CdSnPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4807057125,
"spacegroup": 71
},
{
"id": "jvasp-18622",
"created_at": "2022-09-04T14:35:55.075505Z",
"updated_at": "2022-09-04T14:35:55.075532Z",
"structure_string": "Pr2 Au4\n1.0\n4.316617 0.000000 1.868930\n1.825085 5.440841 1.704102\n-0.028965 0.020144 5.986352\nPr Au\n2 4\ndirect\n0.530716 0.719283 0.219284 Pr\n0.469285 0.280716 0.780716 Pr\n0.163569 0.307723 0.365138 Au\n0.836432 0.692276 0.634861 Au\n0.163569 0.865137 0.807723 Au\n0.836432 0.134862 0.192276 Au\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"Au"
],
"chemical_system": "Au-Pr",
"density": 12.614440569354521,
"density_atomic": 0.04261040207551991,
"volume": 140.81068724406754,
"volume_molar": 14.133029651601854,
"formula_full": "Pr2 Au4",
"formula_reduced": "PrAu2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4807149966666667,
"spacegroup": 74
},
{
"id": "jvasp-78407",
"created_at": "2022-09-04T14:37:14.436690Z",
"updated_at": "2022-09-04T14:37:14.436718Z",
"structure_string": "Pr1 Sb1\n1.0\n-3.217882 -3.217882 -0.000000\n-3.217882 -0.000000 -3.217882\n0.000000 -3.217882 -3.217882\nPr Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 6.545085844815897,
"density_atomic": 0.030011635050898714,
"volume": 66.64082102184929,
"volume_molar": 20.066020227777177,
"formula_full": "Pr1 Sb1",
"formula_reduced": "PrSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.481107975,
"spacegroup": 225
},
{
"id": "jvasp-19975",
"created_at": "2022-09-04T14:37:43.714375Z",
"updated_at": "2022-09-04T14:37:43.714399Z",
"structure_string": "Pr1 Sb1\n1.0\n3.941082 0.000000 2.275384\n1.313694 3.715687 2.275384\n0.000000 0.000000 4.550769\nPr Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.499999 0.500000 0.499999 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Sb"
],
"chemical_system": "Pr-Sb",
"density": 6.545100220591818,
"density_atomic": 0.030011700969138865,
"volume": 66.64067465075061,
"volume_molar": 20.065976154409203,
"formula_full": "Pr1 Sb1",
"formula_reduced": "PrSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.481107975,
"spacegroup": 225
},
{
"id": "jvasp-69459",
"created_at": "2022-09-04T14:35:53.290201Z",
"updated_at": "2022-09-04T14:35:53.290229Z",
"structure_string": "Be2 Cd1 Cu1\n1.0\n2.856305 0.000000 -0.000000\n0.000000 2.856305 0.000000\n-0.000000 0.000000 5.986857\nBe Cd Cu\n2 1 1\ndirect\n0.000000 0.000000 0.007958 Be\n0.500001 0.500001 0.191992 Be\n0.000000 0.000000 0.485398 Cd\n0.500001 0.500001 0.814653 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Cu"
],
"chemical_system": "Be-Cd-Cu",
"density": 6.5947913733332,
"density_atomic": 0.081893973993854,
"volume": 48.843642638470484,
"volume_molar": 7.353582280000177,
"formula_full": "Be2 Cd1 Cu1",
"formula_reduced": "Be2CdCu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.48121475625,
"spacegroup": 99
},
{
"id": "jvasp-36467",
"created_at": "2022-09-04T14:37:30.080547Z",
"updated_at": "2022-09-04T14:37:30.080574Z",
"structure_string": "Ca3 Sb1 P1\n1.0\n5.360682 0.000000 0.000000\n0.000000 5.360682 0.000000\n0.000000 0.000000 5.360682\nCa Sb P\n3 1 1\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 Sb\n0.500000 0.500000 0.500000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Sb",
"P"
],
"chemical_system": "Ca-P-Sb",
"density": 2.9423905743790146,
"density_atomic": 0.03245711157629513,
"volume": 154.04944424111113,
"volume_molar": 18.554148744394855,
"formula_full": "Ca3 Sb1 P1",
"formula_reduced": "Ca3SbP",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.4813885719999999,
"spacegroup": 221
},
{
"id": "jvasp-88061",
"created_at": "2022-09-04T14:36:21.374437Z",
"updated_at": "2022-09-04T14:36:21.374459Z",
"structure_string": "Pr2 Zr4 F22\n1.0\n6.960115 -0.000000 3.630119\n3.191395 7.468891 2.368520\n0.014098 -0.013624 8.460428\nPr Zr F\n2 4 22\ndirect\n0.750000 0.250000 0.250000 Pr\n0.250000 0.750000 0.750000 Pr\n0.632944 0.819567 0.180433 Zr\n0.367056 0.180434 0.819567 Zr\n0.867056 0.319567 0.680433 Zr\n0.132944 0.680433 0.319567 Zr\n0.130218 0.280792 0.719209 F\n0.535041 0.176266 0.548545 F\n0.240149 0.676266 0.048545 F\n0.106336 0.204595 0.053679 F\n0.464959 0.823734 0.451455 F\n0.500000 0.000000 0.000000 F\n0.035041 0.048545 0.676266 F\n0.606336 0.553680 0.704595 F\n0.135390 0.704595 0.553679 F\n0.259852 0.451456 0.823734 F\n0.393664 0.446321 0.295405 F\n0.369783 0.780791 0.219209 F\n0.635390 0.053680 0.204595 F\n0.740148 0.548545 0.176266 F\n0.893664 0.795406 0.946321 F\n0.630217 0.219209 0.780791 F\n0.364610 0.946321 0.795405 F\n0.964959 0.951455 0.323734 F\n0.869782 0.719209 0.280791 F\n0.759851 0.323735 0.951456 F\n0.864609 0.295406 0.446321 F\n0.000000 0.500000 0.500000 F\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Pr",
"Zr",
"F"
],
"chemical_system": "F-Pr-Zr",
"density": 4.02266064532438,
"density_atomic": 0.06370958803215553,
"volume": 439.49428751395834,
"volume_molar": 9.452487366517742,
"formula_full": "Pr2 Zr4 F22",
"formula_reduced": "PrZr2F11",
"formula_anonymous": "AB2C11",
"energy_above_hull": 0.4814051398214288,
"spacegroup": 72
},
{
"id": "jvasp-18368",
"created_at": "2022-09-04T14:38:09.148733Z",
"updated_at": "2022-09-04T14:38:09.148759Z",
"structure_string": "K2 Os1 Cl6\n1.0\n5.939994 -0.000000 3.429457\n1.979998 5.600280 3.429457\n0.000000 -0.000000 6.858914\nK Os Cl\n2 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Os\n0.757416 0.242584 0.757416 Cl\n0.757416 0.242584 0.242584 Cl\n0.757416 0.757416 0.242584 Cl\n0.242584 0.757416 0.242584 Cl\n0.242584 0.242584 0.757416 Cl\n0.242584 0.757416 0.757416 Cl\n",
"nsites": 9,
"nelements": 3,
"elements": [
"K",
"Os",
"Cl"
],
"chemical_system": "Cl-K-Os",
"density": 3.5016570428226665,
"density_atomic": 0.03944494950409865,
"volume": 228.16609257073145,
"volume_molar": 15.267203623557057,
"formula_full": "K2 Os1 Cl6",
"formula_reduced": "K2OsCl6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.4815028227777778,
"spacegroup": 225
},
{
"id": "jvasp-81793",
"created_at": "2022-09-04T14:37:19.463770Z",
"updated_at": "2022-09-04T14:37:19.463799Z",
"structure_string": "Cd1 Sn1 Pd2\n1.0\n-9.235675 0.000000 -5.332219\n-6.081278 0.214151 -0.131358\n-5.206603 2.688104 -1.646339\nCd Sn Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 -0.000000 Sn\n0.746789 0.000000 -0.000000 Pd\n0.253211 0.000000 -0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cd",
"Sn",
"Pd"
],
"chemical_system": "Cd-Pd-Sn",
"density": 9.077212997914025,
"density_atomic": 0.049251402173461765,
"volume": 81.21596185042887,
"volume_molar": 12.227348855551819,
"formula_full": "Cd1 Sn1 Pd2",
"formula_reduced": "CdSnPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4816382125,
"spacegroup": 71
}
]
}