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=updated_at&page=482",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=480",
"results": [
{
"id": "jvasp-107743",
"created_at": "2022-09-04T14:35:56.613873Z",
"updated_at": "2022-09-04T14:35:56.613892Z",
"structure_string": "Pu1 Ta1 C2\n1.0\n3.154529 0.003145 5.028203\n1.449064 2.802013 5.028203\n0.005161 0.003145 5.935810\nPu Ta C\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pu\n0.500000 0.499998 0.500001 Ta\n0.240738 0.240736 0.240738 C\n0.759263 0.759259 0.759264 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pu",
"Ta",
"C"
],
"chemical_system": "C-Pu-Ta",
"density": 14.243958597066252,
"density_atomic": 0.07642315632890385,
"volume": 52.34015699096646,
"volume_molar": 7.8799948200024525,
"formula_full": "Pu1 Ta1 C2",
"formula_reduced": "PuTaC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 6.5406573,
"spacegroup": 166
},
{
"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-65535",
"created_at": "2022-09-04T14:35:56.620623Z",
"updated_at": "2022-09-04T14:35:56.620655Z",
"structure_string": "K2 Ba1 V1\n1.0\n4.162901 0.000000 0.000000\n-0.000000 4.162901 -0.000000\n0.000000 0.000000 11.465677\nK Ba V\n2 1 1\ndirect\n0.000000 0.000000 0.992590 K\n0.500000 0.500000 0.314670 K\n0.500000 0.500000 0.679208 Ba\n0.000000 0.000000 0.513532 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"V"
],
"chemical_system": "Ba-K-V",
"density": 2.2268838440950596,
"density_atomic": 0.020131128571726296,
"volume": 198.69725563314455,
"volume_molar": 29.914571051212487,
"formula_full": "K2 Ba1 V1",
"formula_reduced": "K2BaV",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7274915425000001,
"spacegroup": 99
},
{
"id": "jvasp-70453",
"created_at": "2022-09-04T14:35:56.621633Z",
"updated_at": "2022-09-04T14:35:56.621645Z",
"structure_string": "Be2 Ni1 Pd1\n1.0\n-1.646113 1.646113 3.919860\n1.646113 -1.646113 3.919860\n1.646113 1.646113 -3.919860\nBe Ni Pd\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.500000 0.500000 0.000000 Ni\n0.749999 0.250000 0.499999 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ni",
"Pd"
],
"chemical_system": "Be-Ni-Pd",
"density": 7.157760584958209,
"density_atomic": 0.09414779528245076,
"volume": 42.486390552213,
"volume_molar": 6.396475607244021,
"formula_full": "Be2 Ni1 Pd1",
"formula_reduced": "Be2NiPd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.522557575,
"spacegroup": 119
},
{
"id": "jvasp-96781",
"created_at": "2022-09-04T14:35:56.622861Z",
"updated_at": "2022-09-04T14:35:56.622881Z",
"structure_string": "K8 Se4 O16\n1.0\n5.964567 -0.000000 0.000000\n-0.000000 7.634883 0.000000\n0.000000 0.000000 10.422801\nK Se O\n8 4 16\ndirect\n0.750000 0.161920 0.918042 K\n0.250000 0.838079 0.081958 K\n0.750000 0.661920 0.581958 K\n0.250000 0.338079 0.418042 K\n0.750000 -0.004287 0.295349 K\n0.250000 0.004287 0.704651 K\n0.750000 0.495712 0.204651 K\n0.250000 0.504287 0.795349 K\n0.750000 0.222295 0.580375 Se\n0.750000 0.722295 0.919625 Se\n0.250000 0.277705 0.080375 Se\n0.250000 0.777705 0.419625 Se\n0.021082 0.206698 0.157418 O\n0.521082 0.793302 0.842582 O\n0.250000 0.495583 0.073308 O\n0.021082 0.706698 0.342582 O\n0.521082 0.293302 0.657418 O\n0.478918 0.206698 0.157418 O\n0.978918 0.793302 0.842582 O\n0.750000 0.311283 0.432851 O\n0.250000 0.688717 0.567149 O\n0.750000 0.811283 0.067149 O\n0.250000 0.188717 0.932851 O\n0.750000 0.004417 0.573308 O\n0.250000 0.995583 0.426692 O\n0.750000 0.504416 0.926692 O\n0.978918 0.293302 0.657418 O\n0.478918 0.706698 0.342582 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"K",
"Se",
"O"
],
"chemical_system": "K-O-Se",
"density": 3.0948423197786425,
"density_atomic": 0.05899188557263151,
"volume": 474.64154990479267,
"volume_molar": 10.208422228825807,
"formula_full": "K8 Se4 O16",
"formula_reduced": "K2SeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.280023338095238,
"spacegroup": 62
},
{
"id": "jvasp-43117",
"created_at": "2022-09-04T14:35:56.628150Z",
"updated_at": "2022-09-04T14:35:56.628175Z",
"structure_string": "Mn3 Cr2 Sb3 O16\n1.0\n6.050181 0.027054 0.038028\n-3.001662 5.199077 -0.000013\n0.055950 0.032304 8.835247\nMn Cr Sb O\n3 2 3 16\ndirect\n0.660847 0.830431 0.214491 Mn\n0.826798 0.661613 0.708986 Mn\n0.826795 0.165198 0.708987 Mn\n0.342179 0.671098 0.497254 Cr\n0.684248 0.342133 0.981261 Cr\n0.163325 0.830491 0.209588 Sb\n0.163324 0.332850 0.209589 Sb\n0.328339 0.164176 0.708442 Sb\n0.831357 0.668223 0.104204 O\n0.676308 0.338162 0.597647 O\n0.537343 0.049742 0.840884 O\n0.537346 0.487616 0.840882 O\n0.669986 0.835002 0.601273 O\n0.336064 0.168046 0.093739 O\n0.477917 0.526405 0.339470 O\n0.012206 0.006106 0.329801 O\n0.160521 0.336068 0.601694 O\n0.982437 0.991225 0.815152 O\n0.950610 0.475314 0.831954 O\n0.317511 0.658768 0.084196 O\n0.044736 0.522372 0.350871 O\n0.160523 0.824469 0.601695 O\n0.477921 0.951533 0.339467 O\n0.831356 0.163152 0.104205 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Mn",
"Cr",
"Sb",
"O"
],
"chemical_system": "Cr-Mn-O-Sb",
"density": 5.3047688628690475,
"density_atomic": 0.08613926475227533,
"volume": 278.61858432412555,
"volume_molar": 6.991168054799223,
"formula_full": "Mn3 Cr2 Sb3 O16",
"formula_reduced": "Mn3Cr2Sb3O16",
"formula_anonymous": "A2B3C3D16",
"energy_above_hull": 3.4233879510057474,
"spacegroup": 8
},
{
"id": "jvasp-69988",
"created_at": "2022-09-04T14:35:56.629173Z",
"updated_at": "2022-09-04T14:35:56.629184Z",
"structure_string": "Y1 Be2 W1\n1.0\n-2.098880 2.098880 3.448039\n2.098880 -2.098880 3.448039\n2.098880 2.098880 -3.448039\nY Be W\n1 2 1\ndirect\n0.750000 0.250000 0.500000 Y\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.250000 0.750000 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Be",
"W"
],
"chemical_system": "Be-W-Y",
"density": 7.94678812967683,
"density_atomic": 0.06583435911815816,
"volume": 60.758546959056474,
"volume_molar": 9.1474130540127,
"formula_full": "Y1 Be2 W1",
"formula_reduced": "YBe2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.7121494125,
"spacegroup": 139
},
{
"id": "jvasp-14941",
"created_at": "2022-09-04T14:35:56.633847Z",
"updated_at": "2022-09-04T14:35:56.633876Z",
"structure_string": "Pr1 Ag1\n1.0\n3.760081 -0.000000 0.000000\n0.000000 3.760081 -0.000000\n-0.000000 0.000000 3.760081\nPr Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Ag"
],
"chemical_system": "Ag-Pr",
"density": 7.770799692695247,
"density_atomic": 0.03762169807346454,
"volume": 53.160811510808614,
"volume_molar": 16.007094491695888,
"formula_full": "Pr1 Ag1",
"formula_reduced": "PrAg",
"formula_anonymous": "AB",
"energy_above_hull": 0.327958555,
"spacegroup": 221
},
{
"id": "jvasp-85951",
"created_at": "2022-09-04T14:35:56.635537Z",
"updated_at": "2022-09-04T14:35:56.635561Z",
"structure_string": "Pr2 Ta2 Cl2 O7\n1.0\n3.833048 0.000002 -0.983875\n-0.701247 6.382068 -2.731933\n0.011002 0.023103 8.001228\nPr Ta Cl O\n2 2 2 7\ndirect\n0.308595 0.833784 0.617189 Pr\n0.691404 0.166216 0.382811 Pr\n0.965686 0.202712 0.931383 Ta\n0.034313 0.797287 0.068617 Ta\n0.677169 0.566414 0.354335 Cl\n0.322830 0.433585 0.645665 Cl\n0.456497 0.165507 0.912997 O\n0.543502 0.834492 0.087003 O\n0.918709 0.847802 0.837420 O\n-0.000000 0.500000 0.000000 O\n0.826053 0.071552 0.652110 O\n0.081290 0.152197 0.162580 O\n0.173946 0.928448 0.347890 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
"Pr",
"Ta",
"Cl",
"O"
],
"chemical_system": "Cl-O-Pr-Ta",
"density": 7.001064252968598,
"density_atomic": 0.06630650863631202,
"volume": 196.0591843449995,
"volume_molar": 9.082276964741348,
"formula_full": "Pr2 Ta2 Cl2 O7",
"formula_reduced": "Pr2Ta2Cl2O7",
"formula_anonymous": "A2B2C2D7",
"energy_above_hull": 2.957950825769231,
"spacegroup": 12
},
{
"id": "jvasp-71597",
"created_at": "2022-09-04T14:35:56.637285Z",
"updated_at": "2022-09-04T14:35:56.637317Z",
"structure_string": "Zr2 Be1 W1\n1.0\n2.807558 0.000000 0.000000\n0.000000 2.807558 0.000000\n0.000000 0.000000 8.784457\nZr Be W\n2 1 1\ndirect\n0.000000 0.000000 0.977117 Zr\n0.500000 0.500000 0.302903 Zr\n0.000000 0.000000 0.517843 Be\n0.500000 0.500000 0.702138 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Be",
"W"
],
"chemical_system": "Be-W-Zr",
"density": 9.000268741849855,
"density_atomic": 0.05776803514577416,
"volume": 69.24244506336836,
"volume_molar": 10.424693768454285,
"formula_full": "Zr2 Be1 W1",
"formula_reduced": "Zr2BeW",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.625108775,
"spacegroup": 99
},
{
"id": "jvasp-67585",
"created_at": "2022-09-04T14:35:56.638283Z",
"updated_at": "2022-09-04T14:35:56.638301Z",
"structure_string": "Li1 Be1 Fe1\n1.0\n-1.238126 1.238126 5.354038\n1.238126 -1.238126 5.354038\n1.238126 1.238126 -5.354038\nLi Be Fe\n1 1 1\ndirect\n0.663525 0.663525 0.000000 Li\n0.985738 0.985738 0.000000 Be\n0.350738 0.350738 0.000000 Fe\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Be",
"Fe"
],
"chemical_system": "Be-Fe-Li",
"density": 3.631544892613777,
"density_atomic": 0.0913797839357699,
"volume": 32.830018531327184,
"volume_molar": 6.590233091635359,
"formula_full": "Li1 Be1 Fe1",
"formula_reduced": "LiBeFe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8016672,
"spacegroup": 107
},
{
"id": "jvasp-68117",
"created_at": "2022-09-04T14:35:56.641463Z",
"updated_at": "2022-09-04T14:35:56.641488Z",
"structure_string": "Be1 Zn2 Re1\n1.0\n2.851469 0.000000 0.000000\n-0.000000 2.851469 0.000000\n0.000000 0.000000 6.424274\nBe Zn Re\n1 2 1\ndirect\n0.000000 0.000000 0.508375 Be\n0.000000 0.000000 0.000581 Zn\n0.500000 0.500000 0.279793 Zn\n0.500000 0.500000 0.711250 Re\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Re"
],
"chemical_system": "Be-Re-Zn",
"density": 10.364655310416811,
"density_atomic": 0.07657704909224944,
"volume": 52.23497180181693,
"volume_molar": 7.86415881962931,
"formula_full": "Be1 Zn2 Re1",
"formula_reduced": "BeZn2Re",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4551037249999998,
"spacegroup": 99
}
]
}