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=4324",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=4322",
"results": [
{
"id": "jvasp-9419",
"created_at": "2022-09-04T14:37:11.392209Z",
"updated_at": "2022-09-04T14:37:11.392232Z",
"structure_string": "Na4 Pd2 F8\n1.0\n0.000000 3.430933 -0.028004\n5.629885 0.000000 0.000000\n0.000000 -0.826521 -9.959210\nNa Pd F\n4 2 8\ndirect\n0.719294 0.044248 0.651694 Na\n0.280706 0.544248 0.848306 Na\n0.280706 0.955753 0.348305 Na\n0.719293 0.455752 0.151694 Na\n0.000000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 Pd\n0.783835 0.680467 0.338511 F\n0.216164 0.180466 0.161488 F\n0.216164 0.319534 0.661488 F\n0.783836 0.819534 0.838511 F\n0.213187 0.805836 0.575039 F\n0.786813 0.305836 0.924960 F\n0.213187 0.694165 0.075039 F\n0.786813 0.194165 0.424960 F\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Na",
"Pd",
"F"
],
"chemical_system": "F-Na-Pd",
"density": 3.9403194584288554,
"density_atomic": 0.0727272722472149,
"volume": 192.5000012706531,
"volume_molar": 8.280443599657513,
"formula_full": "Na4 Pd2 F8",
"formula_reduced": "Na2PdF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-80430",
"created_at": "2022-09-04T14:37:19.123477Z",
"updated_at": "2022-09-04T14:37:19.123495Z",
"structure_string": "Ba2 Tl1 Ag1\n1.0\n-11.350382 -0.000000 -6.553147\n-11.888457 -0.001721 7.485120\n-7.745469 11.716420 0.309253\nBa Tl Ag\n2 1 1\ndirect\n0.752664 -0.000000 -0.000000 Ba\n0.247336 -0.000000 -0.000000 Ba\n0.500000 -0.000000 -0.000000 Tl\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Ag"
],
"chemical_system": "Ag-Ba-Tl",
"density": 0.5107063440437799,
"density_atomic": 0.002096109504456491,
"volume": 1908.297248543404,
"volume_molar": 287.3008660662271,
"formula_full": "Ba2 Tl1 Ag1",
"formula_reduced": "Ba2TlAg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-35278",
"created_at": "2022-09-04T14:37:30.732840Z",
"updated_at": "2022-09-04T14:37:30.732850Z",
"structure_string": "Tm1 In1 Cu4\n1.0\n-3.600377 -3.600377 -0.000000\n-3.600377 -0.000000 -3.600377\n0.000000 -3.600377 -3.600377\nTm In Cu\n1 1 4\ndirect\n0.750001 0.750001 0.750001 Tm\n0.000000 0.000000 0.000000 In\n0.374975 0.374975 0.374975 Cu\n0.875077 0.374975 0.374975 Cu\n0.374975 0.875077 0.374975 Cu\n0.374975 0.374975 0.875077 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"In",
"Cu"
],
"chemical_system": "Cu-In-Tm",
"density": 9.569867937761753,
"density_atomic": 0.06428021470693888,
"volume": 93.34131859009356,
"volume_molar": 9.36857598789247,
"formula_full": "Tm1 In1 Cu4",
"formula_reduced": "TmInCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"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-102258",
"created_at": "2022-09-04T14:37:10.049354Z",
"updated_at": "2022-09-04T14:37:10.049378Z",
"structure_string": "K2 Hg1 Sb1 I6\n1.0\n7.451386 -0.000000 4.302060\n2.483795 7.025234 4.302060\n-0.000000 -0.000000 8.604119\nK Hg Sb I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n0.752496 0.247505 0.247505 I\n0.247505 0.247505 0.752495 I\n0.247506 0.752495 0.752495 I\n0.247506 0.752495 0.247505 I\n0.752496 0.247505 0.752495 I\n0.752496 0.752495 0.247505 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Hg",
"Sb",
"I"
],
"chemical_system": "Hg-I-K-Sb",
"density": 4.28391679294003,
"density_atomic": 0.022202185950284465,
"volume": 450.4061006601864,
"volume_molar": 27.124089373383715,
"formula_full": "K2 Hg1 Sb1 I6",
"formula_reduced": "K2HgSbI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-12935",
"created_at": "2022-09-04T14:37:10.894382Z",
"updated_at": "2022-09-04T14:37:10.894399Z",
"structure_string": "K4 Na4 Se4\n1.0\n4.800702 0.000000 0.000000\n0.000000 8.036597 0.000000\n0.000000 0.000000 8.640238\nK Na Se\n4 4 4\ndirect\n0.750000 0.512346 0.685209 K\n0.750000 0.012345 0.814791 K\n0.250000 0.487655 0.314791 K\n0.250000 0.987655 0.185209 K\n0.750000 0.146809 0.425068 Na\n0.250000 0.853191 0.574932 Na\n0.250000 0.353191 0.925068 Na\n0.750000 0.646809 0.074932 Na\n0.750000 0.779172 0.394468 Se\n0.250000 0.220828 0.605532 Se\n0.750000 0.279172 0.105532 Se\n0.250000 0.720828 0.894468 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"K",
"Na",
"Se"
],
"chemical_system": "K-Na-Se",
"density": 2.8104352877121883,
"density_atomic": 0.03599801895563266,
"volume": 333.3516773461875,
"volume_molar": 16.72908936300704,
"formula_full": "K4 Na4 Se4",
"formula_reduced": "KNaSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-69300",
"created_at": "2022-09-04T14:36:19.213817Z",
"updated_at": "2022-09-04T14:36:19.213834Z",
"structure_string": "Ba1 Na2 Mg1\n1.0\n4.286859 0.000000 0.000000\n0.000000 4.286859 0.000000\n0.000000 0.000000 8.359995\nBa Na Mg\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.198690 Na\n0.000000 0.000000 0.801311 Na\n0.500000 0.500000 0.000000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Mg"
],
"chemical_system": "Ba-Mg-Na",
"density": 2.2439654617229063,
"density_atomic": 0.02603607866783048,
"volume": 153.63296643216472,
"volume_molar": 23.129983730771272,
"formula_full": "Ba1 Na2 Mg1",
"formula_reduced": "BaNa2Mg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-105920",
"created_at": "2022-09-04T14:36:15.508174Z",
"updated_at": "2022-09-04T14:36:15.508194Z",
"structure_string": "Li1 Mg2 Pb1\n1.0\n4.390355 -0.000000 2.534773\n1.463452 4.139267 2.534773\n0.000000 0.000000 5.069546\nLi Mg Pb\n1 2 1\ndirect\n0.500000 0.500000 0.499999 Li\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750001 0.749999 Mg\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Pb"
],
"chemical_system": "Li-Mg-Pb",
"density": 4.735886957528136,
"density_atomic": 0.04341780300214049,
"volume": 92.12810698419726,
"volume_molar": 13.870210705279376,
"formula_full": "Li1 Mg2 Pb1",
"formula_reduced": "LiMg2Pb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-99682",
"created_at": "2022-09-04T14:36:36.215336Z",
"updated_at": "2022-09-04T14:36:36.215347Z",
"structure_string": "Na2 Eu1 Cu1 Cl6\n1.0\n6.286197 0.000000 3.629338\n2.095399 5.926684 3.629338\n0.000000 0.000000 7.258676\nNa Eu Cu Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750001 0.750000 0.750001 Na\n0.000000 0.000000 0.000000 Eu\n0.500000 0.500000 0.500001 Cu\n0.257618 0.742382 0.257618 Cl\n0.742383 0.742382 0.257618 Cl\n0.742383 0.257617 0.742383 Cl\n0.742383 0.257617 0.257618 Cl\n0.257618 0.742382 0.742384 Cl\n0.257617 0.257617 0.742383 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Eu",
"Cu",
"Cl"
],
"chemical_system": "Cl-Cu-Eu-Na",
"density": 2.9117922149254136,
"density_atomic": 0.03697794986866101,
"volume": 270.43143374681915,
"volume_molar": 16.28576159951959,
"formula_full": "Na2 Eu1 Cu1 Cl6",
"formula_reduced": "Na2EuCuCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-105612",
"created_at": "2022-09-04T14:36:20.517084Z",
"updated_at": "2022-09-04T14:36:20.517111Z",
"structure_string": "K2 Rb1 Sc1 F6\n1.0\n5.653794 0.000000 3.264219\n1.884598 5.330447 3.264219\n-0.000000 0.000000 6.528438\nK Rb Sc F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sc\n0.781204 0.218795 0.218796 F\n0.218795 0.218795 0.781205 F\n0.218795 0.781205 0.781205 F\n0.218795 0.781205 0.218795 F\n0.781204 0.218795 0.781205 F\n0.781204 0.781205 0.218796 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Rb",
"Sc",
"F"
],
"chemical_system": "F-K-Rb-Sc",
"density": 2.722795428523781,
"density_atomic": 0.05082613735733413,
"volume": 196.7491633230912,
"volume_molar": 11.848511559438847,
"formula_full": "K2 Rb1 Sc1 F6",
"formula_reduced": "K2RbScF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-95591",
"created_at": "2022-09-04T14:36:14.707614Z",
"updated_at": "2022-09-04T14:36:14.707636Z",
"structure_string": "K2 H2 I4 F24\n1.0\n-4.937769 4.937769 5.203949\n4.937769 -4.937769 5.203949\n4.937769 4.937769 -5.203949\nK H I F\n2 2 4 24\ndirect\n0.250000 0.250000 0.000000 K\n0.750000 0.750000 0.000000 K\n0.250000 0.750000 0.500000 H\n0.750000 0.250000 0.500000 H\n0.656816 0.156816 0.813630 I\n0.343184 0.843184 0.186370 I\n0.156816 0.343184 0.500000 I\n0.843184 0.656816 0.500000 I\n0.148879 0.289747 0.697003 F\n0.648879 0.951876 0.859132 F\n0.092745 0.789747 0.140868 F\n0.548124 0.851122 0.140868 F\n0.407256 0.548124 0.697003 F\n0.048124 0.907256 0.697003 F\n0.210253 0.351121 0.302998 F\n0.592745 0.451876 0.302998 F\n0.851122 0.710253 0.302998 F\n0.710253 0.407256 0.859132 F\n0.789747 0.648879 0.697003 F\n0.708215 0.791786 0.500000 F\n0.289747 0.592745 0.140868 F\n0.451876 0.148879 0.859132 F\n0.351121 0.048124 0.140868 F\n0.291786 0.208214 0.500000 F\n0.208214 0.708215 0.916429 F\n0.791786 0.291786 0.083571 F\n0.861225 0.361225 0.500000 F\n0.361225 0.861225 0.500000 F\n0.138775 0.638775 0.500000 F\n0.638775 0.138775 0.500000 F\n0.951876 0.092745 0.302998 F\n0.907256 0.210253 0.859132 F\n",
"nsites": 32,
"nelements": 4,
"elements": [
"K",
"H",
"I",
"F"
],
"chemical_system": "F-H-I-K",
"density": 3.4151400335713475,
"density_atomic": 0.06305149923906024,
"volume": 507.52163526947635,
"volume_molar": 9.551146019806772,
"formula_full": "K2 H2 I4 F24",
"formula_reduced": "KH(IF6)2",
"formula_anonymous": "ABC2D12",
"energy_above_hull": 0.0,
"spacegroup": 140
},
{
"id": "jvasp-102861",
"created_at": "2022-09-04T14:36:32.892601Z",
"updated_at": "2022-09-04T14:36:32.892619Z",
"structure_string": "Na2 Ga1 Ag1 F6\n1.0\n5.197819 0.000000 3.000962\n1.732606 4.900551 3.000962\n0.000000 0.000000 6.001924\nNa Ga Ag F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Ga\n0.500001 0.500000 0.499999 Ag\n0.775270 0.224731 0.224730 F\n0.224731 0.224731 0.775269 F\n0.224731 0.775269 0.775268 F\n0.224731 0.775269 0.224730 F\n0.775270 0.224731 0.775268 F\n0.775270 0.775269 0.224730 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Ga",
"Ag",
"F"
],
"chemical_system": "Ag-F-Ga-Na",
"density": 3.6664435924161753,
"density_atomic": 0.06540989359166427,
"volume": 152.88207105835107,
"volume_molar": 9.206773515937124,
"formula_full": "Na2 Ga1 Ag1 F6",
"formula_reduced": "Na2GaAgF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}