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=55",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=53",
"results": [
{
"id": "jvasp-93194",
"created_at": "2022-09-04T14:35:52.819975Z",
"updated_at": "2022-09-04T14:35:52.819999Z",
"structure_string": "K1 Mg6 Nb1\n1.0\n6.358791 -1.703660 0.000000\n-4.654808 8.062364 0.000000\n0.000000 0.000000 4.523015\nK Mg Nb\n1 6 1\ndirect\n0.249965 0.374982 0.250000 K\n0.750017 0.375046 0.250000 Mg\n0.750016 0.874970 0.250000 Mg\n0.250000 0.094245 0.749999 Mg\n0.250000 0.655756 0.749999 Mg\n0.688438 0.094219 0.749999 Mg\n0.811566 0.655783 0.749999 Mg\n0.249992 0.874996 0.250000 Nb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Mg",
"Nb"
],
"chemical_system": "K-Mg-Nb",
"density": 2.353704362730945,
"density_atomic": 0.04081373566378451,
"volume": 196.0124421322865,
"volume_molar": 14.755181465399799,
"formula_full": "K1 Mg6 Nb1",
"formula_reduced": "KMg6Nb",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-105675",
"created_at": "2022-09-04T14:35:56.615459Z",
"updated_at": "2022-09-04T14:35:56.615485Z",
"structure_string": "Na2 Hg1 As1 F6\n1.0\n5.551107 0.000000 3.204933\n1.850369 5.233633 3.204933\n-0.000000 -0.000000 6.409865\nNa Hg As F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750001 0.750000 0.750000 Na\n0.500001 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 As\n0.222465 0.222464 0.777536 F\n0.222465 0.777535 0.777536 F\n0.777536 0.777535 0.222464 F\n0.222465 0.777535 0.222464 F\n0.777536 0.222464 0.777535 F\n0.777536 0.222464 0.222464 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Hg",
"As",
"F"
],
"chemical_system": "As-F-Hg-Na",
"density": 3.883176391398113,
"density_atomic": 0.05369925411600892,
"volume": 186.2223258892302,
"volume_molar": 11.214570591595365,
"formula_full": "Na2 Hg1 As1 F6",
"formula_reduced": "Na2HgAsF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-66148",
"created_at": "2022-09-04T14:36:03.746243Z",
"updated_at": "2022-09-04T14:36:03.746276Z",
"structure_string": "Ba1 Mg1 Cd1\n1.0\n0.000000 3.991592 3.991592\n3.991592 0.000000 3.991592\n3.991592 3.991592 -0.000000\nBa Mg Cd\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Cd"
],
"chemical_system": "Ba-Cd-Mg",
"density": 3.5776626278655237,
"density_atomic": 0.02358592039670041,
"volume": 127.19452747833787,
"volume_molar": 25.53277827920795,
"formula_full": "Ba1 Mg1 Cd1",
"formula_reduced": "BaMgCd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-98570",
"created_at": "2022-09-04T14:36:01.468602Z",
"updated_at": "2022-09-04T14:36:01.468633Z",
"structure_string": "Sb4 Xe4 O4 F36\n1.0\n8.539581 -0.040166 -0.369741\n-2.599516 8.780000 -3.334725\n0.016140 -0.068660 10.055199\nSb Xe O F\n4 4 4 36\ndirect\n0.925504 0.747057 0.251630 Sb\n0.433577 0.775896 0.585864 Sb\n0.074496 0.252943 0.748370 Sb\n0.566422 0.224103 0.414136 Sb\n0.560832 0.228757 0.878765 Xe\n0.925846 0.795198 0.723374 Xe\n0.439167 0.771243 0.121234 Xe\n0.074153 0.204802 0.276625 Xe\n0.102766 0.884668 0.864669 O\n0.266480 0.786834 0.019821 O\n0.733519 0.213165 0.980178 O\n0.897233 0.115332 0.135330 O\n0.746781 0.139784 0.401565 F\n0.685879 0.427771 0.865870 F\n0.869166 0.531052 0.166841 F\n0.778942 0.650169 0.795025 F\n0.064407 0.228475 0.927369 F\n0.412841 0.748371 0.762665 F\n0.253218 0.860216 0.598435 F\n0.587158 0.251629 0.237335 F\n0.695050 0.741635 0.235200 F\n0.479098 0.368515 0.039770 F\n0.221057 0.349831 0.204975 F\n0.153740 0.770733 0.285201 F\n0.363252 0.281209 0.421688 F\n0.314120 0.572228 0.134130 F\n0.023442 0.028557 0.656121 F\n0.846259 0.229266 0.714798 F\n0.691247 0.427760 0.521946 F\n0.976558 0.971442 0.343879 F\n0.522735 0.185728 0.585654 F\n0.426385 0.013292 0.306793 F\n0.520901 0.631485 0.960230 F\n0.304949 0.258364 0.764800 F\n0.130833 0.468948 0.833159 F\n0.935592 0.771524 0.072630 F\n0.009887 0.615236 0.629051 F\n0.096510 0.260765 0.561441 F\n0.477264 0.814271 0.414345 F\n0.806992 0.939145 0.839807 F\n0.193007 0.060854 0.160192 F\n0.606089 0.932995 0.078882 F\n0.636748 0.718790 0.578312 F\n0.308752 0.572240 0.478053 F\n-0.009887 0.384764 0.370949 F\n0.393910 0.067005 0.921118 F\n0.903490 0.739235 0.438558 F\n0.573614 0.986708 0.693207 F\n",
"nsites": 48,
"nelements": 4,
"elements": [
"Sb",
"Xe",
"O",
"F"
],
"chemical_system": "F-O-Sb-Xe",
"density": 3.89241140630171,
"density_atomic": 0.0639235189465853,
"volume": 750.8973346744092,
"volume_molar": 9.420853011912753,
"formula_full": "Sb4 Xe4 O4 F36",
"formula_reduced": "SbXeOF9",
"formula_anonymous": "ABCD9",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-88791",
"created_at": "2022-09-04T14:35:47.473277Z",
"updated_at": "2022-09-04T14:35:47.473304Z",
"structure_string": "Ba2 Cu2 Te2 F2\n1.0\n4.464864 0.000000 0.000000\n0.000000 4.464864 -0.000000\n-0.000000 0.000000 9.374175\nBa Cu Te F\n2 2 2 2\ndirect\n0.749999 0.749999 0.658180 Ba\n0.250000 0.250000 0.341819 Ba\n0.749999 0.250000 0.000000 Cu\n0.250000 0.749999 0.000000 Cu\n0.250000 0.250000 0.836994 Te\n0.749999 0.749999 0.163006 Te\n0.250000 0.749999 0.500000 F\n0.749999 0.250000 0.500000 F\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ba",
"Cu",
"Te",
"F"
],
"chemical_system": "Ba-Cu-F-Te",
"density": 6.1751659727837405,
"density_atomic": 0.04280953007912716,
"volume": 186.87427741470577,
"volume_molar": 14.067290037683088,
"formula_full": "Ba2 Cu2 Te2 F2",
"formula_reduced": "BaCuTeF",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-105689",
"created_at": "2022-09-04T14:36:03.628344Z",
"updated_at": "2022-09-04T14:36:03.628362Z",
"structure_string": "Rb3 Sc1 I6\n1.0\n7.623026 -0.000000 4.401156\n2.541009 7.187058 4.401156\n0.000000 0.000000 8.802312\nRb Sc I\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sc\n0.770041 0.229960 0.229960 I\n0.229960 0.229960 0.770040 I\n0.229960 0.770040 0.770040 I\n0.229960 0.770040 0.229960 I\n0.770041 0.229960 0.770040 I\n0.770041 0.770040 0.229960 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Sc",
"I"
],
"chemical_system": "I-Rb-Sc",
"density": 3.659482438821617,
"density_atomic": 0.020735986008281578,
"volume": 482.2534118226247,
"volume_molar": 29.041979279860943,
"formula_full": "Rb3 Sc1 I6",
"formula_reduced": "Rb3ScI6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-65008",
"created_at": "2022-09-04T14:35:43.644458Z",
"updated_at": "2022-09-04T14:35:43.644481Z",
"structure_string": "Sr1 Be1 In4\n1.0\n-0.000000 4.372251 4.372251\n4.372251 -0.000000 4.372251\n4.372251 4.372251 0.000000\nSr Be In\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Be\n0.123360 0.625547 0.625547 In\n0.625547 0.625547 0.625547 In\n0.625547 0.123360 0.625547 In\n0.625547 0.625547 0.123360 In\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Be",
"In"
],
"chemical_system": "Be-In-Sr",
"density": 5.522093880208779,
"density_atomic": 0.035892689126822225,
"volume": 167.16496161097788,
"volume_molar": 16.778182149355086,
"formula_full": "Sr1 Be1 In4",
"formula_reduced": "SrBeIn4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-106047",
"created_at": "2022-09-04T14:35:48.929887Z",
"updated_at": "2022-09-04T14:35:48.929914Z",
"structure_string": "Li2 I1 Br1\n1.0\n4.317464 0.000000 0.000000\n-2.158732 3.739032 -0.000000\n0.000000 -0.000000 6.977937\nLi I Br\n2 1 1\ndirect\n0.666666 0.333333 0.478370 Li\n0.000000 0.000000 0.024624 Li\n0.000000 0.000000 0.626672 I\n0.666666 0.333333 0.120336 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"I",
"Br"
],
"chemical_system": "Br-I-Li",
"density": 3.2532521531461334,
"density_atomic": 0.035509539493553136,
"volume": 112.64578637315789,
"volume_molar": 16.959219539001168,
"formula_full": "Li2 I1 Br1",
"formula_reduced": "Li2IBr",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 156
},
{
"id": "jvasp-93800",
"created_at": "2022-09-04T14:36:12.857577Z",
"updated_at": "2022-09-04T14:36:12.857589Z",
"structure_string": "Yb2 Zn2 Pb2\n1.0\n-2.356452 -4.081566 0.000000\n-2.356452 4.081566 0.000000\n0.000000 0.000000 -7.537199\nYb Zn Pb\n2 2 2\ndirect\n0.999988 0.000011 0.258976 Yb\n0.000011 0.999988 0.758976 Yb\n0.333325 0.666674 0.441276 Zn\n0.666674 0.333325 0.941276 Zn\n0.333336 0.666663 0.040748 Pb\n0.666663 0.333336 0.540748 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Yb",
"Zn",
"Pb"
],
"chemical_system": "Pb-Yb-Zn",
"density": 10.208140307358352,
"density_atomic": 0.041383369770819224,
"volume": 144.98577649012037,
"volume_molar": 14.552079237023396,
"formula_full": "Yb2 Zn2 Pb2",
"formula_reduced": "YbZnPb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-65584",
"created_at": "2022-09-04T14:36:01.500858Z",
"updated_at": "2022-09-04T14:36:01.500869Z",
"structure_string": "Ba1 Na2 Ge1\n1.0\n4.205333 0.000000 0.000000\n0.000000 4.205333 0.000000\n-0.000000 0.000000 7.301103\nBa Na Ge\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.687315 Na\n0.000000 0.000000 0.312685 Na\n0.500000 0.500000 0.500000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Ge"
],
"chemical_system": "Ba-Ge-Na",
"density": 3.2916155122014277,
"density_atomic": 0.03097923818099203,
"volume": 129.11873354117162,
"volume_molar": 19.43927970344672,
"formula_full": "Ba1 Na2 Ge1",
"formula_reduced": "BaNa2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-71116",
"created_at": "2022-09-04T14:36:08.121378Z",
"updated_at": "2022-09-04T14:36:08.121402Z",
"structure_string": "Be1 Zn2 Bi1\n1.0\n3.295914 -0.000000 -0.000000\n-0.000000 3.295914 -0.000000\n0.000000 0.000000 6.912429\nBe Zn Bi\n1 2 1\ndirect\n0.000000 -0.000000 0.410290 Be\n0.000000 -0.000000 0.064824 Zn\n0.499999 0.499999 0.288348 Zn\n0.499999 0.499999 0.736540 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Bi"
],
"chemical_system": "Be-Bi-Zn",
"density": 7.713585955710277,
"density_atomic": 0.05326937060149091,
"volume": 75.09005559543907,
"volume_molar": 11.305072111798992,
"formula_full": "Be1 Zn2 Bi1",
"formula_reduced": "BeZn2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-107004",
"created_at": "2022-09-04T14:36:43.377740Z",
"updated_at": "2022-09-04T14:36:43.377750Z",
"structure_string": "Tb1 Mg2 Cu1\n1.0\n4.203212 -0.000000 2.426726\n1.401071 3.962827 2.426726\n-0.000000 -0.000000 4.853452\nTb Mg Cu\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.250000 0.250000 0.250000 Mg\n0.749999 0.750001 0.750001 Mg\n0.499999 0.500000 0.500001 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Mg",
"Cu"
],
"chemical_system": "Cu-Mg-Tb",
"density": 5.5681585073441235,
"density_atomic": 0.04947921989735676,
"volume": 80.84201829167651,
"volume_molar": 12.171050336874266,
"formula_full": "Tb1 Mg2 Cu1",
"formula_reduced": "TbMg2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}