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=-nelements&page=1073",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=1071",
"results": [
{
"id": "jvasp-64227",
"created_at": "2022-09-04T14:36:17.757107Z",
"updated_at": "2022-09-04T14:36:17.757153Z",
"structure_string": "Ba4 Sc1 Pd1\n1.0\n-0.000000 4.978537 4.978537\n4.978537 0.000000 4.978537\n4.978537 4.978537 -0.000000\nBa Sc Pd\n4 1 1\ndirect\n0.127387 0.624205 0.624205 Ba\n0.624205 0.624205 0.624205 Ba\n0.624205 0.127387 0.624205 Ba\n0.624205 0.624205 0.127387 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sc",
"Pd"
],
"chemical_system": "Ba-Pd-Sc",
"density": 4.7145042382080335,
"density_atomic": 0.02431173971003075,
"volume": 246.79435003676303,
"volume_molar": 24.770505244901635,
"formula_full": "Ba4 Sc1 Pd1",
"formula_reduced": "Ba4ScPd",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7205958049999999,
"spacegroup": 216
},
{
"id": "jvasp-4609",
"created_at": "2022-09-04T14:36:17.762156Z",
"updated_at": "2022-09-04T14:36:17.762189Z",
"structure_string": "Mn2 P2 Se6\n1.0\n5.791033 -0.000322 4.932609\n2.277772 5.324264 4.932613\n-0.000492 -0.000330 7.607016\nMn P Se\n2 2 6\ndirect\n0.832472 0.832472 0.832473 Mn\n0.167527 0.167527 0.167528 Mn\n0.556344 0.556344 0.556344 P\n0.443656 0.443656 0.443656 P\n0.412416 0.754359 0.078167 Se\n0.078167 0.412416 0.754360 Se\n0.754359 0.078167 0.412417 Se\n0.587584 0.245641 0.921834 Se\n0.921833 0.587584 0.245641 Se\n0.245640 0.921833 0.587584 Se\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mn",
"P",
"Se"
],
"chemical_system": "Mn-P-Se",
"density": 4.570111553031698,
"density_atomic": 0.04263096905487761,
"volume": 234.571257039156,
"volume_molar": 14.126211281399385,
"formula_full": "Mn2 P2 Se6",
"formula_reduced": "MnPSe3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.3841845682758613,
"spacegroup": 148
},
{
"id": "jvasp-92287",
"created_at": "2022-09-04T14:36:17.769854Z",
"updated_at": "2022-09-04T14:36:17.769871Z",
"structure_string": "Fe1 Bi1 O3\n1.0\n3.737601 0.000000 0.000000\n0.000000 3.737601 0.000000\n0.000000 0.000000 4.845206\nFe Bi O\n1 1 3\ndirect\n0.500000 0.500000 0.480364 Fe\n0.000000 0.000000 0.045501 Bi\n0.000000 0.500000 0.329505 O\n0.500000 0.000000 0.329505 O\n0.500000 0.500000 0.857129 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Fe",
"Bi",
"O"
],
"chemical_system": "Bi-Fe-O",
"density": 7.674506992755591,
"density_atomic": 0.07387064369496109,
"volume": 67.6858864347633,
"volume_molar": 8.152278711510384,
"formula_full": "Fe1 Bi1 O3",
"formula_reduced": "FeBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.19809806,
"spacegroup": 99
},
{
"id": "jvasp-66233",
"created_at": "2022-09-04T14:36:17.783316Z",
"updated_at": "2022-09-04T14:36:17.783342Z",
"structure_string": "Ba1 Mg1 Br1\n1.0\n-0.000000 4.030932 4.030932\n4.030932 0.000000 4.030932\n4.030932 4.030932 -0.000000\nBa Mg Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Br"
],
"chemical_system": "Ba-Br-Mg",
"density": 3.061854548931423,
"density_atomic": 0.022902075574676363,
"volume": 130.9924941177474,
"volume_molar": 26.295174602684895,
"formula_full": "Ba1 Mg1 Br1",
"formula_reduced": "BaMgBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-94994",
"created_at": "2022-09-04T14:36:17.785110Z",
"updated_at": "2022-09-04T14:36:17.785146Z",
"structure_string": "Rb2 Ni1 F4\n1.0\n3.943964 -0.000000 -1.126610\n-0.321820 3.930812 -1.126610\n-0.011581 -0.012568 7.426153\nRb Ni F\n2 1 4\ndirect\n0.646928 0.646929 0.293857 Rb\n0.353071 0.353070 0.706142 Rb\n0.000000 0.000000 0.000000 Ni\n0.499999 0.000000 -0.000000 F\n0.000000 0.500000 -0.000000 F\n0.852162 0.852162 0.704326 F\n0.147837 0.147837 0.295674 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Ni",
"F"
],
"chemical_system": "F-Ni-Rb",
"density": 4.4124215052127775,
"density_atomic": 0.06086119156500337,
"volume": 115.01582239847512,
"volume_molar": 9.894878173011113,
"formula_full": "Rb2 Ni1 F4",
"formula_reduced": "Rb2NiF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-90751",
"created_at": "2022-09-04T14:36:17.795067Z",
"updated_at": "2022-09-04T14:36:17.795096Z",
"structure_string": "Tb2 In2 Pt4\n1.0\n-2.291333 -3.968416 -0.000000\n-2.291333 3.968416 0.000000\n0.000000 0.000000 -9.070125\nTb In Pt\n2 2 4\ndirect\n0.666677 0.333322 0.750000 Tb\n0.333322 0.666677 0.250000 Tb\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.666645 0.333353 0.092681 Pt\n0.333353 0.666645 0.907319 Pt\n0.333353 0.666645 0.592682 Pt\n0.666645 0.333353 0.407319 Pt\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tb",
"In",
"Pt"
],
"chemical_system": "In-Pt-Tb",
"density": 13.367202170115675,
"density_atomic": 0.04849995293114531,
"volume": 164.94861368953255,
"volume_molar": 12.416797122565349,
"formula_full": "Tb2 In2 Pt4",
"formula_reduced": "TbInPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2974502925000002,
"spacegroup": 194
},
{
"id": "jvasp-74546",
"created_at": "2022-09-04T14:36:17.798135Z",
"updated_at": "2022-09-04T14:36:17.798162Z",
"structure_string": "Sc1 Be1 Br2\n1.0\n4.690958 0.000000 0.000000\n0.000000 4.690958 0.000000\n-0.000000 0.000000 3.626374\nSc Be Br\n1 1 2\ndirect\n0.500000 0.500000 0.499999 Sc\n0.000000 0.000000 0.499999 Be\n0.500000 0.000000 0.000000 Br\n0.000000 0.500000 0.000000 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Br"
],
"chemical_system": "Be-Br-Sc",
"density": 4.448489334589286,
"density_atomic": 0.05012614544545523,
"volume": 79.79867521137447,
"volume_molar": 12.013971364610496,
"formula_full": "Sc1 Be1 Br2",
"formula_reduced": "ScBeBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.04611989,
"spacegroup": 123
},
{
"id": "jvasp-89295",
"created_at": "2022-09-04T14:36:17.807390Z",
"updated_at": "2022-09-04T14:36:17.807412Z",
"structure_string": "Ca4 Ga4 Ge4\n1.0\n4.234726 -0.000000 -0.000000\n-2.117362 3.667380 0.000000\n0.000000 0.000000 17.280556\nCa Ga Ge\n4 4 4\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.250000 Ca\n0.000000 0.000000 0.750000 Ca\n0.333334 0.666667 0.154358 Ga\n0.666668 0.333333 0.654358 Ga\n0.666668 0.333333 0.845643 Ga\n0.333334 0.666667 0.345643 Ga\n0.333334 0.666667 0.609428 Ge\n0.666668 0.333333 0.109428 Ge\n0.666668 0.333333 0.390572 Ge\n0.333334 0.666667 0.890572 Ge\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ca",
"Ga",
"Ge"
],
"chemical_system": "Ca-Ga-Ge",
"density": 4.515362205030043,
"density_atomic": 0.044713874826062,
"volume": 268.3730731608539,
"volume_molar": 13.468170189737002,
"formula_full": "Ca4 Ga4 Ge4",
"formula_reduced": "CaGaGe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-90809",
"created_at": "2022-09-04T14:36:17.810989Z",
"updated_at": "2022-09-04T14:36:17.811011Z",
"structure_string": "La2 Ga4 Ni2\n1.0\n0.000000 0.000000 -4.255616\n-4.257753 -0.000000 0.000000\n2.128877 8.809012 0.000000\nLa Ga Ni\n2 4 2\ndirect\n0.000000 0.858477 0.716957 La\n0.000000 0.141521 0.283042 La\n0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 0.000000 Ga\n0.500000 0.709315 0.418631 Ga\n0.500000 0.290683 0.581368 Ga\n0.500000 0.572087 0.144175 Ni\n0.500000 0.427911 0.855825 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"La",
"Ga",
"Ni"
],
"chemical_system": "Ga-La-Ni",
"density": 7.012884983213466,
"density_atomic": 0.05012101862543869,
"volume": 159.6136754479215,
"volume_molar": 12.01520025960424,
"formula_full": "La2 Ga4 Ni2",
"formula_reduced": "LaGa2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.3483955125,
"spacegroup": 65
},
{
"id": "jvasp-74922",
"created_at": "2022-09-04T14:36:17.813990Z",
"updated_at": "2022-09-04T14:36:17.814016Z",
"structure_string": "Be1 In2 Sb1\n1.0\n4.777547 -0.000000 -0.000000\n0.000000 4.777547 0.000000\n-0.000000 0.000000 4.197570\nBe In Sb\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Be\n0.500000 0.000000 0.000000 In\n0.000000 0.500000 0.000000 In\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"In",
"Sb"
],
"chemical_system": "Be-In-Sb",
"density": 6.246487216883465,
"density_atomic": 0.04174957969029969,
"volume": 95.80934777480839,
"volume_molar": 14.424434460592224,
"formula_full": "Be1 In2 Sb1",
"formula_reduced": "BeIn2Sb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7428155349999999,
"spacegroup": 123
},
{
"id": "jvasp-1849",
"created_at": "2022-09-04T14:36:17.820123Z",
"updated_at": "2022-09-04T14:36:17.820137Z",
"structure_string": "Li2 Ag1 Sb1\n1.0\n4.062710 0.000000 2.345607\n1.354236 3.830359 2.345607\n0.000000 0.000000 4.691213\nLi Ag Sb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.500000 0.500000 0.500000 Li\n0.750001 0.750000 0.750000 Ag\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ag",
"Sb"
],
"chemical_system": "Ag-Li-Sb",
"density": 5.538929016830106,
"density_atomic": 0.05479230062728625,
"volume": 73.00295760912114,
"volume_molar": 10.990852165461014,
"formula_full": "Li2 Ag1 Sb1",
"formula_reduced": "Li2AgSb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5643458400000001,
"spacegroup": 216
},
{
"id": "jvasp-73699",
"created_at": "2022-09-04T14:36:17.919922Z",
"updated_at": "2022-09-04T14:36:17.919957Z",
"structure_string": "Ta1 Be1 Fe1\n1.0\n1.503130 -2.603499 0.000000\n1.503130 2.603499 -0.000000\n-0.000000 0.000000 4.926447\nTa Be Fe\n1 1 1\ndirect\n0.666667 0.333333 0.675950 Ta\n0.000000 -0.000000 0.034330 Be\n0.333333 0.666667 0.289722 Fe\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Fe"
],
"chemical_system": "Be-Fe-Ta",
"density": 10.585762629192963,
"density_atomic": 0.07780427966977099,
"volume": 38.558290273145204,
"volume_molar": 7.740115049660641,
"formula_full": "Ta1 Be1 Fe1",
"formula_reduced": "TaBeFe",
"formula_anonymous": "ABC",
"energy_above_hull": 3.6275302666666662,
"spacegroup": 156
}
]
}