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=-created_at&page=3413",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=3411",
"results": [
{
"id": "jvasp-91382",
"created_at": "2022-09-04T14:36:21.948466Z",
"updated_at": "2022-09-04T14:36:21.948502Z",
"structure_string": "Fe2 Cu2 O4\n1.0\n2.832870 0.000000 -0.000000\n-1.416436 2.453338 0.000000\n-0.000000 -0.000000 11.583291\nFe Cu O\n2 2 4\ndirect\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.666667 0.333335 0.750000 Cu\n0.333332 0.666666 0.250000 Cu\n0.333332 0.666666 0.411258 O\n0.666667 0.333335 0.911258 O\n0.666667 0.333335 0.588742 O\n0.333332 0.666666 0.088742 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Fe",
"Cu",
"O"
],
"chemical_system": "Cu-Fe-O",
"density": 6.245392111712577,
"density_atomic": 0.09937427861355048,
"volume": 80.50372904955242,
"volume_molar": 6.060059850516321,
"formula_full": "Fe2 Cu2 O4",
"formula_reduced": "FeCuO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6770482375000002,
"spacegroup": 194
},
{
"id": "jvasp-91817",
"created_at": "2022-09-04T14:36:21.948189Z",
"updated_at": "2022-09-04T14:36:21.948215Z",
"structure_string": "Np2 H6\n1.0\n-1.856238 -3.214973 -0.000000\n-1.856238 3.214973 0.000000\n0.000000 -0.000000 -6.615874\nNp H\n2 6\ndirect\n0.666644 0.333357 0.750000 Np\n0.333357 0.666644 0.250000 Np\n-0.000019 0.000019 0.750000 H\n0.000019 -0.000019 0.250000 H\n0.666668 0.333332 0.093822 H\n0.333332 0.666668 0.906177 H\n0.333332 0.666668 0.593822 H\n0.666668 0.333332 0.406178 H\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Np",
"H"
],
"chemical_system": "H-Np",
"density": 10.094974500041868,
"density_atomic": 0.10131220714489361,
"volume": 78.96383096815417,
"volume_molar": 5.9441413129883935,
"formula_full": "Np2 H6",
"formula_reduced": "NpH3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.630565,
"spacegroup": 194
},
{
"id": "jvasp-18422",
"created_at": "2022-09-04T14:36:21.944615Z",
"updated_at": "2022-09-04T14:36:21.944644Z",
"structure_string": "Li3 Cu2 O4\n1.0\n2.728708 0.016324 -4.479346\n-0.329241 3.408865 -3.972644\n-0.052147 -0.023644 10.496863\nLi Cu O\n3 2 4\ndirect\n0.285271 0.785273 0.750001 Li\n0.283616 0.783617 0.250001 Li\n0.710658 0.210658 0.750000 Li\n0.005266 0.505268 0.750000 Cu\n0.998887 0.498886 0.250000 Cu\n0.342769 0.363008 0.986283 O\n0.635042 0.608403 0.983677 O\n0.641049 0.667692 0.516324 O\n0.390442 0.370206 0.513717 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"Cu",
"O"
],
"chemical_system": "Cu-Li-O",
"density": 3.6422902942425597,
"density_atomic": 0.09315607643651917,
"volume": 96.61205521180375,
"volume_molar": 6.464571062204153,
"formula_full": "Li3 Cu2 O4",
"formula_reduced": "Li3(CuO2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.273589433333333,
"spacegroup": 5
},
{
"id": "jvasp-65172",
"created_at": "2022-09-04T14:36:21.944417Z",
"updated_at": "2022-09-04T14:36:21.944441Z",
"structure_string": "Be1 P1 Rh1\n1.0\n-1.590910 1.590910 3.531884\n1.590910 -1.590910 3.531884\n1.590910 1.590910 -3.531884\nBe P Rh\n1 1 1\ndirect\n0.005129 0.005129 0.000000 Be\n0.325070 0.325070 0.000000 P\n0.669799 0.669799 0.000000 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"P",
"Rh"
],
"chemical_system": "Be-P-Rh",
"density": 6.635867052296727,
"density_atomic": 0.08390031834387626,
"volume": 35.75671772428936,
"volume_molar": 7.177732908375247,
"formula_full": "Be1 P1 Rh1",
"formula_reduced": "BePRh",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1743848666666663,
"spacegroup": 107
},
{
"id": "jvasp-95133",
"created_at": "2022-09-04T14:36:21.938004Z",
"updated_at": "2022-09-04T14:36:21.938020Z",
"structure_string": "Re4 Cl10 O8\n1.0\n5.361234 0.034724 0.913612\n1.110679 8.090739 3.385769\n0.159948 0.062308 11.027948\nRe Cl O\n4 10 8\ndirect\n0.211321 0.405616 0.351224 Re\n0.334613 0.893312 0.810415 Re\n0.788678 0.594383 0.648776 Re\n0.665387 0.106687 0.189586 Re\n0.568235 0.109409 0.700734 Cl\n0.979626 0.364142 0.787303 Cl\n0.431764 0.890591 0.299266 Cl\n0.218964 0.928568 0.609456 Cl\n0.020374 0.635857 0.212697 Cl\n0.781036 0.071432 0.390544 Cl\n0.772134 0.373068 0.108657 Cl\n0.583668 0.803350 0.979820 Cl\n0.227866 0.626932 0.891344 Cl\n0.416332 0.196650 0.020180 Cl\n0.479493 0.447414 0.387027 O\n0.983986 0.670280 0.503163 O\n0.702389 0.746288 0.719193 O\n0.073137 0.990524 0.872660 O\n0.297611 0.253712 0.280808 O\n0.926862 0.009476 0.127340 O\n0.016014 0.329720 0.496838 O\n0.520507 0.552586 0.612973 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Re",
"Cl",
"O"
],
"chemical_system": "Cl-O-Re",
"density": 4.284396274375083,
"density_atomic": 0.04624807461993003,
"volume": 475.69547880203805,
"volume_molar": 13.021386964733951,
"formula_full": "Re4 Cl10 O8",
"formula_reduced": "Re2Cl5O4",
"formula_anonymous": "A2B4C5",
"energy_above_hull": 2.5436536670454544,
"spacegroup": 2
},
{
"id": "jvasp-100054",
"created_at": "2022-09-04T14:36:21.935800Z",
"updated_at": "2022-09-04T14:36:21.935833Z",
"structure_string": "Ca2 Pd1 N2\n1.0\n3.417370 0.000000 -0.919687\n-0.247468 3.408396 -0.919538\n0.003538 0.004249 6.822115\nCa Pd N\n2 1 2\ndirect\n0.155383 0.155383 0.810766 Ca\n0.844617 0.844618 0.189234 Ca\n0.500000 0.500001 0.500000 Pd\n0.652930 0.652919 0.805860 N\n0.347070 0.347083 0.194140 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Pd",
"N"
],
"chemical_system": "Ca-N-Pd",
"density": 4.482883224066101,
"density_atomic": 0.0629028129891274,
"volume": 79.48770114405278,
"volume_molar": 9.573722499565976,
"formula_full": "Ca2 Pd1 N2",
"formula_reduced": "Ca2PdN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.216574608,
"spacegroup": 139
},
{
"id": "jvasp-90791",
"created_at": "2022-09-04T14:36:21.929926Z",
"updated_at": "2022-09-04T14:36:21.929954Z",
"structure_string": "Hf1 Ti1 F6\n1.0\n8.187469 -0.000000 0.000000\n4.093734 4.093734 -0.000000\n4.093734 -0.000000 4.093734\nHf Ti F\n1 1 6\ndirect\n0.500000 0.000000 0.000000 Hf\n0.000000 0.000000 0.000000 Ti\n0.254131 0.000000 0.000000 F\n0.254131 0.491737 0.000000 F\n0.254131 0.000000 0.491737 F\n0.745870 0.000000 0.000000 F\n0.745870 0.000000 0.508262 F\n0.745870 0.508262 0.000000 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Hf",
"Ti",
"F"
],
"chemical_system": "F-Hf-Ti",
"density": 4.1189133021752875,
"density_atomic": 0.058304366169868026,
"volume": 137.21099337041483,
"volume_molar": 10.328798948700813,
"formula_full": "Hf1 Ti1 F6",
"formula_reduced": "HfTiF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.7828691285416666,
"spacegroup": 225
},
{
"id": "jvasp-17346",
"created_at": "2022-09-04T14:36:21.927797Z",
"updated_at": "2022-09-04T14:36:21.927821Z",
"structure_string": "Mo1 O2\n1.0\n2.804541 0.000556 4.255722\n1.276587 2.497153 4.255722\n0.000909 0.000556 5.096726\nMo O\n1 2\ndirect\n0.500002 0.500000 0.499999 Mo\n0.753122 0.753121 0.753119 O\n0.246881 0.246878 0.246878 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mo",
"O"
],
"chemical_system": "Mo-O",
"density": 5.954683734646685,
"density_atomic": 0.08408694698649025,
"volume": 35.67735668274402,
"volume_molar": 7.161802129607038,
"formula_full": "Mo1 O2",
"formula_reduced": "MoO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.613980966666666,
"spacegroup": 166
},
{
"id": "jvasp-18953",
"created_at": "2022-09-04T14:36:21.927060Z",
"updated_at": "2022-09-04T14:36:21.927087Z",
"structure_string": "Mg6 Hg2\n1.0\n2.421008 -4.193310 0.000000\n2.421008 4.193310 -0.000000\n0.000000 -0.000000 8.642268\nMg Hg\n6 2\ndirect\n0.666667 0.333333 0.077473 Mg\n0.333333 0.666667 0.577473 Mg\n0.000000 0.000000 0.750000 Mg\n0.000000 0.000000 0.250000 Mg\n0.666667 0.333333 0.422528 Mg\n0.333333 0.666667 0.922528 Mg\n0.333333 0.666667 0.250000 Hg\n0.666667 0.333333 0.750000 Hg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg",
"density": 5.176466925555758,
"density_atomic": 0.045590994645003324,
"volume": 175.47324997606262,
"volume_molar": 13.209057637131446,
"formula_full": "Mg6 Hg2",
"formula_reduced": "Mg3Hg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1023670833333333,
"spacegroup": 194
},
{
"id": "jvasp-95041",
"created_at": "2022-09-04T14:36:21.922537Z",
"updated_at": "2022-09-04T14:36:21.922563Z",
"structure_string": "Si2 Ni2 Sb2\n1.0\n4.075440 -0.000000 -0.000000\n0.000000 4.075440 -0.000000\n-0.000000 -0.000000 6.548671\nSi Ni Sb\n2 2 2\ndirect\n0.750000 0.750000 0.800743 Si\n0.250000 0.250000 0.199257 Si\n0.750000 0.250000 0.000000 Ni\n0.250000 0.750000 0.000000 Ni\n0.750000 0.750000 0.303694 Sb\n0.250000 0.250000 0.696305 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Si",
"Ni",
"Sb"
],
"chemical_system": "Ni-Sb-Si",
"density": 6.36742725103865,
"density_atomic": 0.05516315162024832,
"volume": 108.76825967640373,
"volume_molar": 10.916962833192255,
"formula_full": "Si2 Ni2 Sb2",
"formula_reduced": "SiNiSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7363223666666667,
"spacegroup": 129
},
{
"id": "jvasp-42150",
"created_at": "2022-09-04T14:36:21.916874Z",
"updated_at": "2022-09-04T14:36:21.916901Z",
"structure_string": "Li5 Ti2 Cu3 O10\n1.0\n5.063355 -0.020311 -0.003814\n-1.524534 5.323257 0.029322\n-1.745750 -2.262615 7.018643\nLi Ti Cu O\n5 2 3 10\ndirect\n0.214442 0.878867 0.381449 Li\n0.401843 0.318283 0.800311 Li\n0.500000 0.500000 0.500000 Li\n0.598156 0.681717 0.199689 Li\n0.785557 0.121133 0.618551 Li\n0.096207 0.698424 0.691451 Ti\n0.903793 0.301576 0.308549 Ti\n0.698830 0.887187 0.899720 Cu\n0.301169 0.112813 0.100280 Cu\n0.000000 0.500000 -0.000000 Cu\n0.648874 0.327722 0.066093 O\n0.061692 0.031835 0.838615 O\n0.351126 0.672278 0.933907 O\n0.129507 0.332142 0.548958 O\n0.220494 0.527716 0.245824 O\n0.460936 0.872789 0.660399 O\n0.539064 0.127211 0.339601 O\n0.779506 0.472284 0.754176 O\n0.870493 0.667858 0.451042 O\n0.938308 0.968165 0.161385 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Cu",
"O"
],
"chemical_system": "Cu-Li-O-Ti",
"density": 4.221106098734254,
"density_atomic": 0.10568126159447057,
"volume": 189.24830852933758,
"volume_molar": 5.698399762777898,
"formula_full": "Li5 Ti2 Cu3 O10",
"formula_reduced": "Li5Ti2Cu3O10",
"formula_anonymous": "A2B3C5D10",
"energy_above_hull": 2.0443256508333336,
"spacegroup": 2
},
{
"id": "jvasp-99435",
"created_at": "2022-09-04T14:36:21.915980Z",
"updated_at": "2022-09-04T14:36:21.916017Z",
"structure_string": "Zn2 Cu1 Rh1\n1.0\n3.668456 -0.000000 2.117984\n1.222819 3.458654 2.117984\n-0.000000 -0.000000 4.235968\nZn Cu Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Zn\n0.750001 0.749999 0.749999 Zn\n0.500001 0.499999 0.499999 Cu\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Cu",
"Rh"
],
"chemical_system": "Cu-Rh-Zn",
"density": 9.184517525658524,
"density_atomic": 0.07442466498758421,
"volume": 53.74562318375628,
"volume_molar": 8.091592701162492,
"formula_full": "Zn2 Cu1 Rh1",
"formula_reduced": "Zn2CuRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}