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=formula_anonymous&page=4633",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4631",
"results": [
{
"id": "jvasp-94834",
"created_at": "2022-09-04T14:35:47.747006Z",
"updated_at": "2022-09-04T14:35:47.747033Z",
"structure_string": "Ba1 Zn1 B1 O3 F1\n1.0\n0.000000 0.000000 -4.335599\n-2.549185 -4.415312 0.000000\n-2.549168 4.415302 0.000000\nBa Zn B O F\n1 1 1 3 1\ndirect\n0.500000 0.666676 0.333337 Ba\n0.000000 0.333345 0.666671 Zn\n0.000000 0.000007 0.000006 B\n0.000000 0.975017 0.258133 O\n0.000000 0.741882 0.716889 O\n0.000000 0.283122 0.024991 O\n0.500000 0.333354 0.666676 F\n",
"nsites": 7,
"nelements": 5,
"elements": [
"Ba",
"Zn",
"B",
"O",
"F"
],
"chemical_system": "B-Ba-F-O-Zn",
"density": 4.7731991315084485,
"density_atomic": 0.07172294684055398,
"volume": 97.5977746084747,
"volume_molar": 8.396393379356978,
"formula_full": "Ba1 Zn1 B1 O3 F1",
"formula_reduced": "BaZnBO3F",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.1937342479761903,
"spacegroup": 174
},
{
"id": "jvasp-26755",
"created_at": "2022-09-04T14:38:29.083151Z",
"updated_at": "2022-09-04T14:38:29.083188Z",
"structure_string": "K2 Cu2 C2 O6 F2\n1.0\n4.014058 0.000000 0.000000\n0.000000 5.095228 0.000000\n0.000000 0.000000 8.998435\nK Cu C O F\n2 2 2 6 2\ndirect\n0.500000 0.708859 0.077338 K\n0.500000 0.291142 0.577339 K\n0.000000 0.789611 0.732739 Cu\n0.000000 0.210389 0.232738 Cu\n0.000000 0.784730 0.413662 C\n0.000000 0.215270 0.913663 C\n0.000000 0.328407 0.787713 O\n0.000000 0.040627 0.425069 O\n0.000000 0.645891 0.534883 O\n0.000000 0.671594 0.287713 O\n0.000000 0.354109 0.034883 O\n0.000000 0.959374 0.925069 O\n0.500000 0.806629 0.728599 F\n0.500000 0.193372 0.228599 F\n",
"nsites": 14,
"nelements": 5,
"elements": [
"K",
"Cu",
"C",
"O",
"F"
],
"chemical_system": "C-Cu-F-K-O",
"density": 3.2779632366050984,
"density_atomic": 0.0760700647459744,
"volume": 184.0408582107967,
"volume_molar": 7.916571098118712,
"formula_full": "K2 Cu2 C2 O6 F2",
"formula_reduced": "KCuCO3F",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.6831870332142862,
"spacegroup": 26
},
{
"id": "jvasp-54561",
"created_at": "2022-09-04T14:38:36.666497Z",
"updated_at": "2022-09-04T14:38:36.666516Z",
"structure_string": "Ca2 Sm2 Cu2 Cl2 O6\n1.0\n3.907934 0.000000 0.000000\n0.000000 3.907934 0.000000\n0.000000 0.000000 13.432649\nCa Sm Cu Cl O\n2 2 2 2 6\ndirect\n0.499999 0.000000 0.159234 Ca\n0.000000 0.499999 0.840766 Ca\n0.499999 0.000000 0.409923 Sm\n0.000000 0.499999 0.590077 Sm\n0.499999 0.000000 0.722136 Cu\n0.000000 0.499999 0.277864 Cu\n0.499999 0.000000 0.927059 Cl\n0.000000 0.499999 0.072941 Cl\n0.499999 0.499999 0.726366 O\n0.499999 0.499999 0.273634 O\n0.000000 0.000000 0.726366 O\n0.499999 0.499999 0.500000 O\n0.000000 0.000000 0.273634 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 14,
"nelements": 5,
"elements": [
"Ca",
"Sm",
"Cu",
"Cl",
"O"
],
"chemical_system": "Ca-Cl-Cu-O-Sm",
"density": 5.462775717455338,
"density_atomic": 0.06824517129670028,
"volume": 205.14271902306606,
"volume_molar": 8.824273784614524,
"formula_full": "Ca2 Sm2 Cu2 Cl2 O6",
"formula_reduced": "CaSmCuClO3",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 0.9386649017857144,
"spacegroup": 129
},
{
"id": "jvasp-40360",
"created_at": "2022-09-04T14:37:45.272954Z",
"updated_at": "2022-09-04T14:37:45.272981Z",
"structure_string": "Rb1 Sr1 C1 O3 F1\n1.0\n5.314466 0.000004 0.000000\n-2.657229 4.602321 0.000000\n0.000000 0.000000 4.799705\nRb Sr C O F\n1 1 1 3 1\ndirect\n0.333309 0.666634 0.000000 Rb\n0.666669 0.333340 0.499999 Sr\n0.000011 0.000020 0.499999 C\n0.141174 0.282320 0.499999 O\n0.141138 0.858857 0.499999 O\n0.717718 0.858883 0.499999 O\n0.666687 0.333345 0.000000 F\n",
"nsites": 7,
"nelements": 5,
"elements": [
"Rb",
"Sr",
"C",
"O",
"F"
],
"chemical_system": "C-F-O-Rb-Sr",
"density": 3.56584313153666,
"density_atomic": 0.059627522711554776,
"volume": 117.39545232932379,
"volume_molar": 10.099599121586538,
"formula_full": "Rb1 Sr1 C1 O3 F1",
"formula_reduced": "RbSrCO3F",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.5262681560714284,
"spacegroup": 187
},
{
"id": "jvasp-44564",
"created_at": "2022-09-04T14:37:27.119506Z",
"updated_at": "2022-09-04T14:37:27.119543Z",
"structure_string": "Li2 Tl2 P2 H2 O6\n1.0\n7.100756 2.542294 -0.005895\n-7.100756 2.542294 0.005895\n0.071691 0.000000 5.392327\nLi Tl P H O\n2 2 2 2 6\ndirect\n0.297685 0.802168 0.815892 Li\n0.802167 0.297685 0.184109 Li\n0.110528 0.928569 0.250610 Tl\n0.928569 0.110528 0.749390 Tl\n0.416475 0.699053 0.305835 P\n0.699053 0.416475 0.694166 P\n0.395943 0.503117 0.225016 H\n0.503117 0.395943 0.774984 H\n0.206888 0.640811 0.146097 O\n0.341933 0.643888 0.583391 O\n0.721228 0.990699 0.260131 O\n0.990699 0.721228 0.739868 O\n0.643888 0.341933 0.416610 O\n0.640811 0.206888 0.853904 O\n",
"nsites": 14,
"nelements": 5,
"elements": [
"Li",
"Tl",
"P",
"H",
"O"
],
"chemical_system": "H-Li-O-P-Tl",
"density": 4.969177048491337,
"density_atomic": 0.07190956538416962,
"volume": 194.68898087766777,
"volume_molar": 8.374603194759025,
"formula_full": "Li2 Tl2 P2 H2 O6",
"formula_reduced": "LiTlPHO3",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.8404255142857144,
"spacegroup": 5
},
{
"id": "jvasp-86949",
"created_at": "2022-09-04T14:36:16.679135Z",
"updated_at": "2022-09-04T14:36:16.679151Z",
"structure_string": "K1 Ca1 C1 O3 F1\n1.0\n5.107877 -0.000000 0.000000\n-2.553938 4.423551 0.000000\n0.000000 0.000000 4.465172\nK Ca C O F\n1 1 1 3 1\ndirect\n0.000000 0.000000 0.000000 K\n0.333333 0.666667 0.500000 Ca\n0.666667 0.333333 0.500000 C\n0.813028 0.626057 0.500000 O\n0.373943 0.186972 0.500000 O\n0.813029 0.186972 0.500000 O\n0.333333 0.666667 0.000000 F\n",
"nsites": 7,
"nelements": 5,
"elements": [
"K",
"Ca",
"C",
"O",
"F"
],
"chemical_system": "C-Ca-F-K-O",
"density": 2.6035198862748232,
"density_atomic": 0.06938224974266546,
"volume": 100.89035777828728,
"volume_molar": 8.679656226680098,
"formula_full": "K1 Ca1 C1 O3 F1",
"formula_reduced": "KCaCO3F",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.5459841717857148,
"spacegroup": 187
},
{
"id": "jvasp-100468",
"created_at": "2022-09-04T14:36:32.676474Z",
"updated_at": "2022-09-04T14:36:32.676503Z",
"structure_string": "Rb1 Sr1 C1 O3 F1\n1.0\n5.314175 0.000000 0.000000\n-2.657088 4.602211 0.000000\n-0.000000 0.000000 4.799016\nRb Sr C O F\n1 1 1 3 1\ndirect\n0.666666 0.333333 0.000000 Rb\n0.000000 0.000000 0.500000 Sr\n0.333332 0.666667 0.500000 C\n0.474485 0.948970 0.500000 O\n0.474485 0.525514 0.500000 O\n0.051029 0.525514 0.500000 O\n0.000000 0.000000 0.000000 F\n",
"nsites": 7,
"nelements": 5,
"elements": [
"Rb",
"Sr",
"C",
"O",
"F"
],
"chemical_system": "C-F-O-Rb-Sr",
"density": 3.566637170350518,
"density_atomic": 0.05964080051589463,
"volume": 117.36931663307332,
"volume_molar": 10.09735065241967,
"formula_full": "Rb1 Sr1 C1 O3 F1",
"formula_reduced": "RbSrCO3F",
"formula_anonymous": "ABCDE3",
"energy_above_hull": 1.526279584642857,
"spacegroup": 187
},
{
"id": "jvasp-48330",
"created_at": "2022-09-04T14:36:14.485746Z",
"updated_at": "2022-09-04T14:36:14.485773Z",
"structure_string": "Na6 Li2 Mn2 B2 P2 O14\n1.0\n0.000000 5.122899 0.112130\n6.513906 0.000000 0.000000\n0.000000 -0.576811 -9.972217\nNa Li Mn B P O\n6 2 2 2 2 14\ndirect\n0.244885 0.750000 0.052991 Na\n0.799288 0.001021 0.226073 Na\n0.799288 0.498980 0.226073 Na\n0.200712 0.501021 0.773928 Na\n0.200712 0.998980 0.773928 Na\n0.755116 0.250000 0.947009 Na\n0.000000 0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.327299 0.250000 0.311775 Mn\n0.672701 0.750000 0.688225 Mn\n0.274748 0.250000 0.060536 B\n0.725253 0.750000 0.939465 B\n0.644555 0.250000 0.581816 P\n0.355446 0.750000 0.418184 P\n0.940964 0.750000 0.863146 O\n0.743782 0.750000 0.076175 O\n0.059036 0.250000 0.136854 O\n0.515605 0.250000 0.137552 O\n0.225402 0.942637 0.347700 O\n0.225402 0.557364 0.347700 O\n0.736305 0.250000 0.434584 O\n0.655739 0.750000 0.417289 O\n0.344261 0.250000 0.582712 O\n0.263696 0.750000 0.565416 O\n0.774598 0.442636 0.652300 O\n0.774598 0.057364 0.652300 O\n0.484395 0.750000 0.862448 O\n0.256219 0.250000 0.923825 O\n",
"nsites": 28,
"nelements": 6,
"elements": [
"Na",
"Li",
"Mn",
"B",
"P",
"O"
],
"chemical_system": "B-Li-Mn-Na-O-P",
"density": 2.84419449862876,
"density_atomic": 0.08424792501896888,
"volume": 332.3523991088878,
"volume_molar": 7.148117604847931,
"formula_full": "Na6 Li2 Mn2 B2 P2 O14",
"formula_reduced": "Na3LiMnBPO7",
"formula_anonymous": "ABCDE3F7",
"energy_above_hull": 2.2396397731937605,
"spacegroup": 11
},
{
"id": "jvasp-33324",
"created_at": "2022-09-04T14:36:50.822596Z",
"updated_at": "2022-09-04T14:36:50.822619Z",
"structure_string": "As2 H6 C2 N2 O2 F18\n1.0\n4.978324 0.080428 -0.499917\n-1.711862 8.052392 -0.023528\n-0.029471 0.112198 8.831820\nAs H C N O F\n2 6 2 2 2 18\ndirect\n0.966113 0.750603 0.660933 As\n0.033887 0.249398 0.339066 As\n0.338142 0.738829 0.364861 H\n0.661858 0.261171 0.635138 H\n0.589968 0.883902 0.298230 H\n0.410032 0.116098 0.701769 H\n0.544675 0.547527 0.302148 H\n0.455325 0.452473 0.697851 H\n0.288424 0.773674 0.126295 C\n0.711576 0.226327 0.873705 C\n0.536561 0.232801 0.724390 N\n0.463439 0.767200 0.275609 N\n0.639218 0.654650 0.263254 O\n0.360782 0.345350 0.736745 O\n0.867942 0.113964 0.857923 F\n0.132058 0.886037 0.142076 F\n0.546638 0.181468 0.982035 F\n0.453362 0.818532 0.017964 F\n0.169423 0.263969 0.163603 F\n0.830577 0.736031 0.836397 F\n0.782096 0.362166 0.271052 F\n0.217904 0.637834 0.728948 F\n0.897467 0.232016 0.519138 F\n0.718314 0.864050 0.583642 F\n0.258833 0.438202 0.403063 F\n0.741167 0.561798 0.596936 F\n0.806071 0.061593 0.277767 F\n0.193929 0.938408 0.722232 F\n0.136720 0.624034 0.097358 F\n0.102533 0.767984 0.480861 F\n0.281686 0.135951 0.416358 F\n0.863280 0.375966 0.902641 F\n",
"nsites": 32,
"nelements": 6,
"elements": [
"As",
"H",
"C",
"N",
"O",
"F"
],
"chemical_system": "As-C-F-H-N-O",
"density": 2.7199344686913665,
"density_atomic": 0.09007705429906306,
"volume": 355.2514039120044,
"volume_molar": 6.685543623580329,
"formula_full": "As2 H6 C2 N2 O2 F18",
"formula_reduced": "AsH3CNOF9",
"formula_anonymous": "ABCDE3F9",
"energy_above_hull": 1.64476694015625,
"spacegroup": 2
},
{
"id": "jvasp-34831",
"created_at": "2022-09-04T14:36:39.030777Z",
"updated_at": "2022-09-04T14:36:39.030809Z",
"structure_string": "Li2 Cu2 P2 O8 F2\n1.0\n5.194281 -0.015262 -0.012167\n-0.742099 5.135879 0.000317\n-2.350799 -2.124288 6.430416\nLi Cu P O F\n2 2 2 8 2\ndirect\n0.432169 0.075784 0.803086 Li\n0.567830 0.924216 0.196915 Li\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.879273 0.543654 0.238063 P\n0.120726 0.456346 0.761938 P\n0.175460 0.310862 0.930751 O\n0.328928 0.355405 0.660230 O\n0.671072 0.644595 0.339770 O\n0.816314 0.353997 0.600122 O\n0.824540 0.689138 0.069249 O\n0.183685 0.646003 0.399878 O\n0.219258 0.772065 0.867949 O\n0.780742 0.227935 0.132052 O\n0.684693 0.895335 0.742497 F\n0.315307 0.104665 0.257504 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Li",
"Cu",
"P",
"O",
"F"
],
"chemical_system": "Cu-F-Li-O-P",
"density": 3.5759443116670613,
"density_atomic": 0.09339788639954891,
"volume": 171.3100865211579,
"volume_molar": 6.447834091488697,
"formula_full": "Li2 Cu2 P2 O8 F2",
"formula_reduced": "LiCuPO4F",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 1.6213800290625,
"spacegroup": 2
},
{
"id": "jvasp-100383",
"created_at": "2022-09-04T14:36:38.455539Z",
"updated_at": "2022-09-04T14:36:38.455563Z",
"structure_string": "In1 Ga1 Cu1 Ag1 Se4\n1.0\n5.389000 -0.007490 -4.642840\n-1.137192 5.267653 -4.642840\n0.006054 0.007490 7.113173\nIn Ga Cu Ag Se\n1 1 1 1 4\ndirect\n0.500000 0.500000 -0.000000 In\n0.750000 0.250000 0.499999 Ga\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.499999 Ag\n0.654332 0.626654 0.529964 Se\n0.096689 0.124367 0.470034 Se\n0.875632 0.345667 0.972321 Se\n0.373346 0.903311 0.027678 Se\n",
"nsites": 8,
"nelements": 5,
"elements": [
"In",
"Ga",
"Cu",
"Ag",
"Se"
],
"chemical_system": "Ag-Cu-Ga-In-Se",
"density": 5.515959913567513,
"density_atomic": 0.0395571591312357,
"volume": 202.23899227593733,
"volume_molar": 15.223895983078092,
"formula_full": "In1 Ga1 Cu1 Ag1 Se4",
"formula_reduced": "InGaCuAgSe4",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 0.5203579339583333,
"spacegroup": 82
},
{
"id": "jvasp-96682",
"created_at": "2022-09-04T14:35:44.577903Z",
"updated_at": "2022-09-04T14:35:44.577925Z",
"structure_string": "Ca2 Mg2 As2 O8 F2\n1.0\n5.474204 -0.007128 -1.337167\n-1.966747 5.108705 -1.337167\n-0.012221 -0.017776 7.113759\nCa Mg As O F\n2 2 2 8 2\ndirect\n0.835911 0.671225 0.750974 Ca\n0.171225 0.335912 0.250974 Ca\n0.503551 0.003569 0.000969 Mg\n0.503569 0.003551 0.500969 Mg\n0.824702 0.682427 0.250975 As\n0.182426 0.324703 0.750976 As\n0.243849 0.622178 0.927104 O\n0.603304 0.674702 0.382149 O\n0.832423 0.903837 0.119811 O\n0.763250 0.384948 0.074840 O\n0.174702 0.103304 0.882150 O\n0.403836 0.332423 0.619811 O\n0.122178 0.743849 0.427105 O\n0.884947 0.263250 0.574840 O\n0.421499 0.085621 0.250972 F\n0.585620 0.921499 0.750972 F\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ca",
"Mg",
"As",
"O",
"F"
],
"chemical_system": "As-Ca-F-Mg-O",
"density": 3.717712505468483,
"density_atomic": 0.08057049850013359,
"volume": 198.58385262409007,
"volume_molar": 7.474374457283536,
"formula_full": "Ca2 Mg2 As2 O8 F2",
"formula_reduced": "CaMgAsO4F",
"formula_anonymous": "ABCDE4",
"energy_above_hull": 1.1980081878125,
"spacegroup": 15
}
]
}