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=4617",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4615",
"results": [
{
"id": "jvasp-86292",
"created_at": "2022-09-04T14:36:12.033824Z",
"updated_at": "2022-09-04T14:36:12.033834Z",
"structure_string": "Sm4 Zn4 Sn4\n1.0\n4.537667 -0.000000 0.000000\n-2.268833 3.929736 0.000000\n-0.000000 0.000000 16.251105\nSm Zn Sn\n4 4 4\ndirect\n0.000000 0.000000 0.500000 Sm\n0.000000 0.000000 0.000000 Sm\n0.000000 0.000000 0.750000 Sm\n0.000000 0.000000 0.250000 Sm\n0.333334 0.666668 0.159928 Zn\n0.666668 0.333333 0.659928 Zn\n0.666668 0.333333 0.840072 Zn\n0.333334 0.666668 0.340072 Zn\n0.666668 0.333333 0.386075 Sn\n0.666668 0.333333 0.113926 Sn\n0.333334 0.666668 0.886075 Sn\n0.333334 0.666668 0.613926 Sn\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Sm",
"Zn",
"Sn"
],
"chemical_system": "Sm-Sn-Zn",
"density": 7.6665337425207305,
"density_atomic": 0.041409725592373006,
"volume": 289.7869963719393,
"volume_molar": 14.542817354745234,
"formula_full": "Sm4 Zn4 Sn4",
"formula_reduced": "SmZnSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-53970",
"created_at": "2022-09-04T14:36:12.400430Z",
"updated_at": "2022-09-04T14:36:12.400449Z",
"structure_string": "Nd1 Mg2 Ag1\n1.0\n3.566162 3.566162 0.000000\n0.000000 3.566162 3.566162\n3.566162 -0.000000 3.566162\nNd Mg Ag\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Nd\n0.750000 0.750000 0.750000 Mg\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Mg",
"Ag"
],
"chemical_system": "Ag-Mg-Nd",
"density": 5.505268429109645,
"density_atomic": 0.04409880202678704,
"volume": 90.70541185155712,
"volume_molar": 13.656018946596229,
"formula_full": "Nd1 Mg2 Ag1",
"formula_reduced": "NdMg2Ag",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-93203",
"created_at": "2022-09-04T14:36:12.228174Z",
"updated_at": "2022-09-04T14:36:12.228195Z",
"structure_string": "Mg6 Ti1 Bi1\n1.0\n6.387425 0.143862 0.000000\n-3.069125 5.315878 0.000000\n0.000000 0.000000 5.264903\nMg Ti Bi\n6 1 1\ndirect\n0.664373 0.329570 0.250000 Mg\n0.664374 0.834804 0.250000 Mg\n0.339348 0.181704 0.750000 Mg\n0.339348 0.657645 0.750000 Mg\n0.845903 0.172952 0.750000 Mg\n0.821035 0.660518 0.750000 Mg\n0.163807 0.331903 0.250000 Ti\n0.161811 0.830904 0.250000 Bi\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Ti",
"Bi"
],
"chemical_system": "Bi-Mg-Ti",
"density": 3.6923615463690025,
"density_atomic": 0.04417614890079187,
"volume": 181.0931961943065,
"volume_molar": 13.632108977005124,
"formula_full": "Mg6 Ti1 Bi1",
"formula_reduced": "Mg6TiBi",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-108056",
"created_at": "2022-09-04T14:36:12.045378Z",
"updated_at": "2022-09-04T14:36:12.045405Z",
"structure_string": "Tl1 In1 F6\n1.0\n4.807522 0.158587 3.418798\n1.848995 4.440568 3.418798\n0.229528 0.158587 5.894724\nTl In F\n1 1 6\ndirect\n0.499999 0.500001 0.500000 Tl\n0.000000 0.000000 0.000000 In\n0.590141 0.922770 0.243235 F\n0.243234 0.590143 0.922768 F\n0.922768 0.243236 0.590142 F\n0.756764 0.409859 0.077232 F\n0.077230 0.756766 0.409858 F\n0.409857 0.077232 0.756765 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tl",
"In",
"F"
],
"chemical_system": "F-In-Tl",
"density": 6.037261938680714,
"density_atomic": 0.06714300315700039,
"volume": 119.14867706011914,
"volume_molar": 8.969126307797755,
"formula_full": "Tl1 In1 F6",
"formula_reduced": "TlInF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-93292",
"created_at": "2022-09-04T14:36:01.366635Z",
"updated_at": "2022-09-04T14:36:01.366650Z",
"structure_string": "Mg5 Hg1\n1.0\n-4.699214 2.713091 0.000000\n0.000000 -5.426184 0.000000\n-1.566406 2.713091 5.135169\nMg Hg\n5 1\ndirect\n0.996443 -0.000000 -0.000000 Mg\n0.670221 0.336889 -0.000000 Mg\n0.333332 0.663113 -0.000000 Mg\n0.500662 0.832669 0.498015 Mg\n0.166004 0.167327 0.501984 Mg\n0.833333 0.499998 0.499998 Hg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg",
"density": 4.084938911388898,
"density_atomic": 0.045822287932359006,
"volume": 130.94064636966525,
"volume_molar": 13.14238339405845,
"formula_full": "Mg5 Hg1",
"formula_reduced": "Mg5Hg",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 155
},
{
"id": "jvasp-22732",
"created_at": "2022-09-04T14:36:12.049666Z",
"updated_at": "2022-09-04T14:36:12.049691Z",
"structure_string": "Cs1 K2 Bi1\n1.0\n-0.000000 4.369830 4.369830\n4.369830 0.000000 4.369830\n4.369830 4.369830 -0.000000\nCs K Bi\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Cs\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.250001 0.250001 0.250001 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cs",
"K",
"Bi"
],
"chemical_system": "Bi-Cs-K",
"density": 4.179843450571394,
"density_atomic": 0.023968252431354472,
"volume": 166.88742791974823,
"volume_molar": 25.12548955017695,
"formula_full": "Cs1 K2 Bi1",
"formula_reduced": "CsK2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-98281",
"created_at": "2022-09-04T14:36:12.132389Z",
"updated_at": "2022-09-04T14:36:12.132408Z",
"structure_string": "Sr2 Cd22\n1.0\n7.125361 -0.000000 3.223396\n3.562680 8.555003 1.611698\n0.036566 -0.000000 9.406221\nSr Cd\n2 22\ndirect\n0.375000 0.250000 0.750000 Sr\n0.625000 0.750000 0.250000 Sr\n0.449238 0.831428 0.927996 Cd\n0.791339 0.927996 0.831428 Cd\n0.280666 0.927996 0.668572 Cd\n0.550762 0.168572 0.072004 Cd\n0.449238 0.427996 0.331428 Cd\n0.719334 0.072004 0.331428 Cd\n0.791338 0.331428 0.427996 Cd\n0.280666 0.168572 0.427996 Cd\n0.500000 0.500000 0.000000 Cd\n0.550763 0.572004 0.668572 Cd\n0.875000 0.250000 0.750000 Cd\n0.877234 0.331428 0.072004 Cd\n0.125000 0.750000 0.250000 Cd\n0.122767 0.668572 0.927996 Cd\n0.877234 0.572004 0.831428 Cd\n0.208662 0.668572 0.572004 Cd\n0.122766 0.427996 0.168572 Cd\n0.208662 0.072004 0.168572 Cd\n0.000000 0.000000 0.000000 Cd\n0.719335 0.831428 0.572004 Cd\n0.000000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Sr",
"Cd"
],
"chemical_system": "Cd-Sr",
"density": 7.683083187000678,
"density_atomic": 0.041930829214318045,
"volume": 572.3712230285387,
"volume_molar": 14.362083633546723,
"formula_full": "Sr2 Cd22",
"formula_reduced": "SrCd11",
"formula_anonymous": "AB11",
"energy_above_hull": 0.0,
"spacegroup": 141
},
{
"id": "jvasp-99805",
"created_at": "2022-09-04T14:36:19.031066Z",
"updated_at": "2022-09-04T14:36:19.031076Z",
"structure_string": "Li1 Ca2 Pb1\n1.0\n4.683890 -0.000000 2.704245\n1.561297 4.416014 2.704245\n0.000000 0.000000 5.408491\nLi Ca Pb\n1 2 1\ndirect\n0.500000 0.500000 0.499999 Li\n0.750001 0.749999 0.749999 Ca\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ca",
"Pb"
],
"chemical_system": "Ca-Li-Pb",
"density": 4.368392897759151,
"density_atomic": 0.0357558207312763,
"volume": 111.86989749339256,
"volume_molar": 16.842406737799532,
"formula_full": "Li1 Ca2 Pb1",
"formula_reduced": "LiCa2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-69196",
"created_at": "2022-09-04T14:36:12.266740Z",
"updated_at": "2022-09-04T14:36:12.266767Z",
"structure_string": "K1 Ba2 Ni1\n1.0\n0.000000 4.180299 4.180299\n4.180299 0.000000 4.180299\n4.180299 4.180299 -0.000000\nK Ba Ni\n1 2 1\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Ni"
],
"chemical_system": "Ba-K-Ni",
"density": 4.23311461685943,
"density_atomic": 0.02737839323665231,
"volume": 146.1006117278305,
"volume_molar": 21.995961223677558,
"formula_full": "K1 Ba2 Ni1",
"formula_reduced": "KBa2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-86312",
"created_at": "2022-09-04T14:36:16.165331Z",
"updated_at": "2022-09-04T14:36:16.165348Z",
"structure_string": "Sr1 Zn5\n1.0\n5.557717 0.000000 0.000000\n-2.778858 4.813124 0.000000\n0.000000 -0.000000 4.260156\nSr Zn\n1 5\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666667 0.333333 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.500000 Zn\n-0.000000 0.500000 0.500000 Zn\n0.333333 0.666666 0.000000 Zn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Zn"
],
"chemical_system": "Sr-Zn",
"density": 6.042233380568225,
"density_atomic": 0.0526504719739459,
"volume": 113.95909238893626,
"volume_molar": 11.43796158746698,
"formula_full": "Sr1 Zn5",
"formula_reduced": "SrZn5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-2196",
"created_at": "2022-09-04T14:36:18.077000Z",
"updated_at": "2022-09-04T14:36:18.077021Z",
"structure_string": "Sn1 F4\n1.0\n3.758151 -0.000000 -1.707986\n-0.776245 3.677088 -1.708004\n-0.046486 -0.057353 4.886312\nSn F\n1 4\ndirect\n0.000000 0.000000 0.000000 Sn\n0.755610 0.755591 0.511222 F\n-0.000001 0.500000 0.000000 F\n0.500000 -0.000000 -0.000000 F\n0.244388 0.244411 0.488778 F\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Sn",
"F"
],
"chemical_system": "F-Sn",
"density": 4.840879343221086,
"density_atomic": 0.07486367714982689,
"volume": 66.78806318841849,
"volume_molar": 8.044142352168612,
"formula_full": "Sn1 F4",
"formula_reduced": "SnF4",
"formula_anonymous": "AB4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-15598",
"created_at": "2022-09-04T14:36:04.651423Z",
"updated_at": "2022-09-04T14:36:04.651444Z",
"structure_string": "Mg1 Sn1 Au1\n1.0\n3.978239 0.000000 2.296838\n1.326080 3.750720 2.296838\n0.000000 -0.000000 4.593675\nMg Sn Au\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500001 Sn\n0.250000 0.250000 0.250001 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"Sn",
"Au"
],
"chemical_system": "Au-Mg-Sn",
"density": 8.236423907800559,
"density_atomic": 0.043767876265914794,
"volume": 68.54342170438635,
"volume_molar": 13.759271122528459,
"formula_full": "Mg1 Sn1 Au1",
"formula_reduced": "MgSnAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
}
]
}