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=-spacegroup&page=426",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=424",
"results": [
{
"id": "jvasp-18735",
"created_at": "2022-09-04T14:37:04.961619Z",
"updated_at": "2022-09-04T14:37:04.961641Z",
"structure_string": "Li2 Mg1 Pb1\n1.0\n4.152651 -0.000000 2.397535\n1.384217 3.915157 2.397535\n0.000000 0.000000 4.795069\nLi Mg Pb\n2 1 1\ndirect\n0.250000 0.250000 0.249999 Li\n0.750000 0.750001 0.749998 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.499999 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Pb"
],
"chemical_system": "Li-Mg-Pb",
"density": 5.226743310756898,
"density_atomic": 0.05130864136183899,
"volume": 77.95957744800111,
"volume_molar": 11.737088724549606,
"formula_full": "Li2 Mg1 Pb1",
"formula_reduced": "Li2MgPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2322126025,
"spacegroup": 225
},
{
"id": "jvasp-12566",
"created_at": "2022-09-04T14:37:04.977102Z",
"updated_at": "2022-09-04T14:37:04.977123Z",
"structure_string": "Sn1 H8 N2 Cl6\n1.0\n6.116390 0.000000 3.531299\n2.038797 5.766587 3.531299\n0.000000 0.000000 7.062599\nSn H N Cl\n1 8 2 6\ndirect\n0.000000 0.000000 0.000000 Sn\n0.309946 0.309946 0.309946 H\n0.690054 0.690055 0.929837 H\n0.929838 0.690055 0.690054 H\n0.690054 0.690055 0.690054 H\n0.070163 0.309946 0.309946 H\n0.309946 0.070163 0.309946 H\n0.309946 0.309946 0.070163 H\n0.690055 0.929838 0.690054 H\n0.250000 0.250000 0.250000 N\n0.750000 0.750000 0.750000 N\n0.247234 0.752766 0.247234 Cl\n0.752766 0.247234 0.752766 Cl\n0.247234 0.752766 0.752766 Cl\n0.752766 0.247234 0.247234 Cl\n0.752766 0.752766 0.247234 Cl\n0.247234 0.247234 0.752766 Cl\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Sn",
"H",
"N",
"Cl"
],
"chemical_system": "Cl-H-N-Sn",
"density": 2.4498172499065416,
"density_atomic": 0.06824492402586019,
"volume": 249.10277566662916,
"volume_molar": 8.824305757477315,
"formula_full": "Sn1 H8 N2 Cl6",
"formula_reduced": "SnH8(NCl3)2",
"formula_anonymous": "AB2C6D8",
"energy_above_hull": 2.3083748591176474,
"spacegroup": 225
},
{
"id": "jvasp-79597",
"created_at": "2022-09-04T14:37:04.990490Z",
"updated_at": "2022-09-04T14:37:04.990510Z",
"structure_string": "Al1 Cu1 Te2\n1.0\n-3.549672 -3.549672 0.000000\n-3.549672 -0.000000 -3.549672\n-0.000000 -3.549672 -3.549672\nAl Cu Te\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 Te\n0.749999 0.749999 0.749999 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Cu",
"Te"
],
"chemical_system": "Al-Cu-Te",
"density": 6.41783284483261,
"density_atomic": 0.044716244399386144,
"volume": 89.45295057146863,
"volume_molar": 13.467456493467663,
"formula_full": "Al1 Cu1 Te2",
"formula_reduced": "AlCuTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8432296958333334,
"spacegroup": 225
},
{
"id": "jvasp-80101",
"created_at": "2022-09-04T14:37:05.021281Z",
"updated_at": "2022-09-04T14:37:05.021298Z",
"structure_string": "Zr1 Co2 Sn1\n1.0\n-3.140482 -3.140482 0.000000\n-3.140482 -0.000000 -3.140482\n0.000000 -3.140482 -3.140482\nZr Co Sn\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Zr\n0.250000 0.250000 0.250000 Co\n0.749999 0.749999 0.749999 Co\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Sn"
],
"chemical_system": "Co-Sn-Zr",
"density": 8.786980084987054,
"density_atomic": 0.0645715289666319,
"volume": 61.94680634040812,
"volume_molar": 9.326309685359954,
"formula_full": "Zr1 Co2 Sn1",
"formula_reduced": "ZrCo2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.725007,
"spacegroup": 225
},
{
"id": "jvasp-18736",
"created_at": "2022-09-04T14:37:05.067970Z",
"updated_at": "2022-09-04T14:37:05.068004Z",
"structure_string": "Li1 Mg2 Tl1\n1.0\n4.250229 -0.000000 2.453871\n1.416743 4.007154 2.453871\n0.000000 0.000000 4.907742\nLi Mg Tl\n1 2 1\ndirect\n0.500000 0.499999 0.500000 Li\n0.250000 0.250000 0.250000 Mg\n0.750000 0.749999 0.750000 Mg\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Tl"
],
"chemical_system": "Li-Mg-Tl",
"density": 5.163956811756276,
"density_atomic": 0.04785528467724952,
"volume": 83.58533497349785,
"volume_molar": 12.584066317053875,
"formula_full": "Li1 Mg2 Tl1",
"formula_reduced": "LiMg2Tl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-51764",
"created_at": "2022-09-04T14:37:05.082200Z",
"updated_at": "2022-09-04T14:37:05.082218Z",
"structure_string": "Na1 In1 H8 N2 F6\n1.0\n4.320808 4.320806 -0.000000\n-0.000000 4.320806 4.320808\n4.320808 0.000000 4.320809\nNa In H N F\n1 1 8 2 6\ndirect\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 In\n0.319049 0.319049 0.319049 H\n0.319049 0.319049 0.042854 H\n0.042853 0.319049 0.319049 H\n0.319049 0.042854 0.319049 H\n0.680952 0.957147 0.680951 H\n0.680952 0.680952 0.957146 H\n0.957147 0.680952 0.680951 H\n0.680952 0.680952 0.680951 H\n0.750001 0.750001 0.750000 N\n0.250000 0.250000 0.250000 N\n0.756188 0.756188 0.243813 F\n0.243814 0.756187 0.756187 F\n0.243813 0.243812 0.756187 F\n0.243814 0.756187 0.243813 F\n0.756187 0.243814 0.243813 F\n0.756187 0.243813 0.756187 F\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Na",
"In",
"H",
"N",
"F"
],
"chemical_system": "F-H-In-N-Na",
"density": 2.9629782402033005,
"density_atomic": 0.11157008272463835,
"volume": 161.33357223033596,
"volume_molar": 5.3976304515817235,
"formula_full": "Na1 In1 H8 N2 F6",
"formula_reduced": "NaInH8(NF3)2",
"formula_anonymous": "ABC2D6E8",
"energy_above_hull": 1.9271181758333336,
"spacegroup": 225
},
{
"id": "jvasp-104501",
"created_at": "2022-09-04T14:37:05.304223Z",
"updated_at": "2022-09-04T14:37:05.304247Z",
"structure_string": "K2 Na1 Y1 Cl6\n1.0\n6.445021 -0.000000 3.721034\n2.148340 6.076424 3.721034\n-0.000000 -0.000000 7.442069\nK Na Y Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Y\n0.752326 0.247674 0.247673 Cl\n0.247674 0.247674 0.752326 Cl\n0.247674 0.752326 0.752326 Cl\n0.247674 0.752326 0.247674 Cl\n0.752326 0.247674 0.752326 Cl\n0.752326 0.752326 0.247673 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Na",
"Y",
"Cl"
],
"chemical_system": "Cl-K-Na-Y",
"density": 2.2950041650266866,
"density_atomic": 0.034311041452863615,
"volume": 291.45136890519524,
"volume_molar": 17.55161168241773,
"formula_full": "K2 Na1 Y1 Cl6",
"formula_reduced": "K2NaYCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-79995",
"created_at": "2022-09-04T14:37:05.436360Z",
"updated_at": "2022-09-04T14:37:05.436380Z",
"structure_string": "Li1 Sn1 Au2\n1.0\n0.000000 3.351680 3.351680\n3.351680 -0.000000 3.351680\n3.351680 3.351680 -0.000000\nLi Sn Au\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.750000 0.750000 Sn\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Sn",
"Au"
],
"chemical_system": "Au-Li-Sn",
"density": 11.45743342755518,
"density_atomic": 0.05311807796019431,
"volume": 75.30392953972327,
"volume_molar": 11.337271586733388,
"formula_full": "Li1 Sn1 Au2",
"formula_reduced": "LiSnAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3934442099999999,
"spacegroup": 225
},
{
"id": "jvasp-59630",
"created_at": "2022-09-04T14:37:05.117553Z",
"updated_at": "2022-09-04T14:37:05.117577Z",
"structure_string": "Rb2 Fe1 Cu1 C6 N6\n1.0\n6.295837 0.000000 3.634903\n2.098612 5.935771 3.634903\n-0.000000 0.000000 7.269806\nRb Fe Cu C N\n2 1 1 6 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Cu\n0.182579 0.817421 0.182579 C\n0.817421 0.182579 0.817421 C\n0.182579 0.817421 0.817421 C\n0.817421 0.817421 0.182578 C\n0.817421 0.182579 0.182578 C\n0.182579 0.182579 0.817421 C\n0.703095 0.703095 0.296905 N\n0.296905 0.703095 0.703095 N\n0.703095 0.296905 0.703095 N\n0.296905 0.703095 0.296905 N\n0.703095 0.296905 0.296905 N\n0.296905 0.296905 0.703095 N\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Rb",
"Fe",
"Cu",
"C",
"N"
],
"chemical_system": "C-Cu-Fe-N-Rb",
"density": 2.7286636591414375,
"density_atomic": 0.05889338920540941,
"volume": 271.6773514968703,
"volume_molar": 10.225495325113435,
"formula_full": "Rb2 Fe1 Cu1 C6 N6",
"formula_reduced": "Rb2FeCu(CN)6",
"formula_anonymous": "ABC2D6E6",
"energy_above_hull": 5.320863465625,
"spacegroup": 225
},
{
"id": "jvasp-79994",
"created_at": "2022-09-04T14:37:05.131770Z",
"updated_at": "2022-09-04T14:37:05.131790Z",
"structure_string": "Ti1 Sn1 Rh2\n1.0\n0.000000 3.176156 3.176156\n3.176156 0.000000 3.176156\n3.176156 3.176156 -0.000000\nTi Sn Rh\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Ti\n0.250001 0.250001 0.250001 Sn\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.500000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Sn",
"Rh"
],
"chemical_system": "Rh-Sn-Ti",
"density": 9.649599846202447,
"density_atomic": 0.06242010867330578,
"volume": 64.08191342529041,
"volume_molar": 9.647757570430816,
"formula_full": "Ti1 Sn1 Rh2",
"formula_reduced": "TiSnRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.348321508333334,
"spacegroup": 225
},
{
"id": "jvasp-51337",
"created_at": "2022-09-04T14:37:05.178298Z",
"updated_at": "2022-09-04T14:37:05.178323Z",
"structure_string": "Na2 Sr1 Fe1\n1.0\n-0.000246 3.850355 3.863468\n3.864822 -0.000445 3.863671\n3.864578 3.850314 -0.000206\nNa Sr Fe\n2 1 1\ndirect\n0.249995 0.249961 0.250002 Na\n0.750003 0.750036 0.749997 Na\n0.499999 0.499998 0.500000 Sr\n0.000004 0.000002 0.000003 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Sr",
"Fe"
],
"chemical_system": "Fe-Na-Sr",
"density": 2.7355693043979863,
"density_atomic": 0.034783760019126544,
"volume": 114.99619356275802,
"volume_molar": 17.313081612478367,
"formula_full": "Na2 Sr1 Fe1",
"formula_reduced": "Na2SrFe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5222799524999999,
"spacegroup": 225
},
{
"id": "jvasp-79886",
"created_at": "2022-09-04T14:37:05.221118Z",
"updated_at": "2022-09-04T14:37:05.221127Z",
"structure_string": "Pm2 Ru1 Rh1\n1.0\n-0.000005 3.492380 3.492380\n3.492367 0.000005 3.492368\n3.492371 3.492372 0.000003\nPm Ru Rh\n2 1 1\ndirect\n0.000001 -0.000000 0.999999 Pm\n0.500000 0.499999 0.500000 Pm\n0.750001 0.750000 0.749998 Ru\n0.249997 0.249999 0.250002 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Ru",
"Rh"
],
"chemical_system": "Pm-Rh-Ru",
"density": 9.628593053598616,
"density_atomic": 0.04695353733905214,
"volume": 85.19059961587016,
"volume_molar": 12.8257445578893,
"formula_full": "Pm2 Ru1 Rh1",
"formula_reduced": "Pm2RuRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.5217439625,
"spacegroup": 225
}
]
}