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=1045",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=1043",
"results": [
{
"id": "jvasp-18027",
"created_at": "2022-09-04T14:38:14.645986Z",
"updated_at": "2022-09-04T14:38:14.646015Z",
"structure_string": "Pr2 Mn2 Ge2\n1.0\n4.083910 0.000000 0.000000\n0.000000 4.083559 0.000000\n0.000000 0.000000 7.427287\nPr Mn Ge\n2 2 2\ndirect\n0.000000 0.500000 0.330221 Pr\n0.500000 0.000000 0.669780 Pr\n0.500000 0.500000 -0.000014 Mn\n0.000000 0.000000 0.000014 Mn\n0.500000 0.000000 0.196824 Ge\n0.000000 0.500000 0.803176 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn-Pr",
"density": 7.198716012463707,
"density_atomic": 0.04844021332306413,
"volume": 123.86402925156368,
"volume_molar": 12.432110320894566,
"formula_full": "Pr2 Mn2 Ge2",
"formula_reduced": "PrMnGe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.8525543471264363,
"spacegroup": 129
},
{
"id": "jvasp-11698",
"created_at": "2022-09-04T14:38:14.640534Z",
"updated_at": "2022-09-04T14:38:14.640563Z",
"structure_string": "V4 Zn2 O8\n1.0\n5.967518 0.002662 -0.003430\n-0.002776 5.967915 -0.000532\n-2.979911 -2.984873 4.221957\nV Zn O\n4 2 8\ndirect\n-0.000000 0.500001 0.000000 V\n0.000000 0.000000 0.500000 V\n0.000000 0.500001 0.500001 V\n0.500000 0.500000 0.000000 V\n0.374981 0.124970 0.249967 Zn\n0.625019 0.875031 0.750034 Zn\n0.759994 0.279966 0.019997 O\n0.759998 0.740037 0.019993 O\n0.220057 0.740019 0.480028 O\n0.240028 0.259987 0.519970 O\n0.779943 0.259983 0.519973 O\n0.240002 0.259965 0.980008 O\n0.759973 0.740014 0.480032 O\n0.240006 0.720036 0.980004 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Zn",
"O"
],
"chemical_system": "O-V-Zn",
"density": 5.111032129955421,
"density_atomic": 0.09315398724489814,
"volume": 150.28878971325784,
"volume_molar": 6.46471604502342,
"formula_full": "V4 Zn2 O8",
"formula_reduced": "V2ZnO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.4163704,
"spacegroup": 227
},
{
"id": "jvasp-12695",
"created_at": "2022-09-04T14:38:14.640118Z",
"updated_at": "2022-09-04T14:38:14.640147Z",
"structure_string": "Mn4 O8\n1.0\n4.955356 0.007307 2.855939\n1.643200 4.670140 2.863535\n0.004585 -0.006455 5.719473\nMn O\n4 8\ndirect\n0.500002 0.500000 0.499998 Mn\n0.000001 0.500000 0.499998 Mn\n0.500000 0.500001 -0.000001 Mn\n0.500000 -0.000000 0.500000 Mn\n0.291448 0.736179 0.736200 O\n0.736173 0.736202 0.736177 O\n0.736181 0.291448 0.736170 O\n0.736202 0.736171 0.291447 O\n0.263828 0.263800 0.263820 O\n0.708554 0.263819 0.263798 O\n0.263799 0.263827 0.708552 O\n0.263820 0.708552 0.263829 O\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mn",
"O"
],
"chemical_system": "Mn-O",
"density": 4.364924803752527,
"density_atomic": 0.09070788657247811,
"volume": 132.2927967284484,
"volume_molar": 6.639048695273198,
"formula_full": "Mn4 O8",
"formula_reduced": "MnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.103414747126437,
"spacegroup": 227
},
{
"id": "jvasp-18163",
"created_at": "2022-09-04T14:38:14.637154Z",
"updated_at": "2022-09-04T14:38:14.637174Z",
"structure_string": "In2 Au1\n1.0\n4.094833 -0.000000 2.364153\n1.364945 3.860645 2.364153\n-0.000000 -0.000000 4.728305\nIn Au\n2 1\ndirect\n0.749998 0.750001 0.750000 In\n0.249999 0.250000 0.250000 In\n0.000000 0.000000 0.000000 Au\n",
"nsites": 3,
"nelements": 2,
"elements": [
"In",
"Au"
],
"chemical_system": "Au-In",
"density": 9.477002992918248,
"density_atomic": 0.04013467112478953,
"volume": 74.7483389280104,
"volume_molar": 15.004833953355538,
"formula_full": "In2 Au1",
"formula_reduced": "In2Au",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-22619",
"created_at": "2022-09-04T14:38:14.634227Z",
"updated_at": "2022-09-04T14:38:14.634262Z",
"structure_string": "Mn2 F4\n1.0\n2.765358 0.000000 0.000000\n0.000000 4.811846 0.000000\n0.000000 -0.000000 4.811846\nMn F\n2 4\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.000000 0.710789 0.710789 F\n0.500000 0.789213 0.210788 F\n0.000000 0.289212 0.289212 F\n0.500000 0.210788 0.789213 F\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mn",
"F"
],
"chemical_system": "F-Mn",
"density": 4.820398029986598,
"density_atomic": 0.0937079524910216,
"volume": 64.02871731270487,
"volume_molar": 6.426499138989294,
"formula_full": "Mn2 F4",
"formula_reduced": "MnF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.6036726021264367,
"spacegroup": 136
},
{
"id": "jvasp-12303",
"created_at": "2022-09-04T14:38:14.634066Z",
"updated_at": "2022-09-04T14:38:14.634093Z",
"structure_string": "Rb1 Ca2 Nb3 O10\n1.0\n3.956432 -0.000000 0.000000\n-0.000000 3.956432 -0.000000\n-0.000000 0.000000 15.162358\nRb Ca Nb O\n1 2 3 10\ndirect\n0.500000 0.500000 0.500000 Rb\n0.500000 0.500000 0.849829 Ca\n0.500000 0.500000 0.150171 Ca\n0.000000 0.000000 0.000000 Nb\n0.000000 0.000000 0.282734 Nb\n0.000000 0.000000 0.717266 Nb\n0.000000 0.000000 0.598143 O\n0.000000 0.000000 0.401858 O\n0.500000 0.000000 0.746338 O\n0.000000 0.500000 0.746338 O\n0.500000 0.000000 0.253662 O\n0.000000 0.500000 0.253662 O\n0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.130420 O\n0.000000 0.000000 0.869580 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"Ca",
"Nb",
"O"
],
"chemical_system": "Ca-Nb-O-Rb",
"density": 4.228185966741769,
"density_atomic": 0.06741333683153636,
"volume": 237.34175983579416,
"volume_molar": 8.933159287232918,
"formula_full": "Rb1 Ca2 Nb3 O10",
"formula_reduced": "RbCa2Nb3O10",
"formula_anonymous": "AB2C3D10",
"energy_above_hull": 2.8437615025,
"spacegroup": 123
},
{
"id": "jvasp-17776",
"created_at": "2022-09-04T14:38:14.632623Z",
"updated_at": "2022-09-04T14:38:14.632648Z",
"structure_string": "Sb4 Rh4\n1.0\n3.920566 0.000000 0.000000\n0.000000 6.062217 0.000000\n0.000000 0.000000 6.444919\nSb Rh\n4 4\ndirect\n0.750001 0.800823 0.591381 Sb\n0.250000 0.199177 0.408619 Sb\n0.750001 0.300823 0.908619 Sb\n0.250000 0.699178 0.091381 Sb\n0.750001 0.994253 0.195987 Rh\n0.250000 0.005748 0.804013 Rh\n0.750001 0.494252 0.304013 Rh\n0.250000 0.505748 0.695987 Rh\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sb",
"Rh"
],
"chemical_system": "Rh-Sb",
"density": 9.741991907610718,
"density_atomic": 0.05222666281265877,
"volume": 153.17846420125755,
"volume_molar": 11.530778410257424,
"formula_full": "Sb4 Rh4",
"formula_reduced": "SbRh",
"formula_anonymous": "AB",
"energy_above_hull": 1.28511955,
"spacegroup": 62
},
{
"id": "jvasp-23432",
"created_at": "2022-09-04T14:38:14.631998Z",
"updated_at": "2022-09-04T14:38:14.632026Z",
"structure_string": "Mg8 Bi4 P4 O24\n1.0\n5.327559 -0.000000 0.000000\n-0.000000 7.852421 0.000000\n0.000000 0.000000 11.939782\nMg Bi P O\n8 4 4 24\ndirect\n0.750000 0.810629 0.599115 Mg\n0.750000 0.296996 0.093230 Mg\n0.750000 0.203004 0.593230 Mg\n0.250000 0.310630 0.900885 Mg\n0.250000 0.796996 0.406770 Mg\n0.250000 0.703004 0.906770 Mg\n0.250000 0.189370 0.400885 Mg\n0.750000 0.689370 0.099115 Mg\n0.250000 0.489293 0.599047 Bi\n0.250000 0.010707 0.099047 Bi\n0.750000 0.510707 0.400952 Bi\n0.750000 0.989293 0.900952 Bi\n0.750000 0.979147 0.301740 P\n0.250000 0.479147 0.198260 P\n0.250000 0.020853 0.698260 P\n0.750000 0.520853 0.801740 P\n0.750000 0.378591 0.713506 O\n0.992832 0.993239 0.374956 O\n0.492832 0.006761 0.625044 O\n0.498104 0.174166 0.994170 O\n0.750000 0.698807 0.747351 O\n0.250000 0.198807 0.752649 O\n0.507168 0.993239 0.374956 O\n0.001896 0.174166 0.994170 O\n0.007168 0.493239 0.125044 O\n0.998104 0.674166 0.505830 O\n0.998104 0.825834 0.005830 O\n0.007168 0.006761 0.625044 O\n0.250000 0.621409 0.286494 O\n0.250000 0.301193 0.252649 O\n0.750000 0.121409 0.213506 O\n0.750000 0.801193 0.247351 O\n0.250000 0.878591 0.786494 O\n0.992832 0.506761 0.874956 O\n0.507168 0.506761 0.874956 O\n0.001896 0.325834 0.494170 O\n0.501897 0.674166 0.505830 O\n0.498104 0.325834 0.494170 O\n0.492832 0.493239 0.125044 O\n0.501897 0.825834 0.005830 O\n",
"nsites": 40,
"nelements": 4,
"elements": [
"Mg",
"Bi",
"P",
"O"
],
"chemical_system": "Bi-Mg-O-P",
"density": 5.113821813652732,
"density_atomic": 0.08008141717355233,
"volume": 499.49166001036247,
"volume_molar": 7.520022712571164,
"formula_full": "Mg8 Bi4 P4 O24",
"formula_reduced": "Mg2BiPO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.7447658900000005,
"spacegroup": 62
},
{
"id": "jvasp-38765",
"created_at": "2022-09-04T14:38:14.631933Z",
"updated_at": "2022-09-04T14:38:14.631944Z",
"structure_string": "Zn1 Ga1 Rh2\n1.0\n0.000000 3.020735 3.020735\n3.020735 0.000000 3.020735\n3.020735 3.020735 -0.000000\nZn Ga Rh\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Zn\n0.250000 0.250000 0.250000 Ga\n0.499999 0.499999 0.499999 Rh\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Ga",
"Rh"
],
"chemical_system": "Ga-Rh-Zn",
"density": 10.26982391391275,
"density_atomic": 0.07255913769911038,
"volume": 55.127446753671144,
"volume_molar": 8.299631102250318,
"formula_full": "Zn1 Ga1 Rh2",
"formula_reduced": "ZnGaRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.79694718125,
"spacegroup": 225
},
{
"id": "jvasp-12293",
"created_at": "2022-09-04T14:38:14.626463Z",
"updated_at": "2022-09-04T14:38:14.626481Z",
"structure_string": "Na2 Ca2 Ta3 O10\n1.0\n3.941722 0.000000 -0.529862\n-0.071227 3.941078 -0.529862\n-0.049402 -0.050302 14.558953\nNa Ca Ta O\n2 2 3 10\ndirect\n0.711667 0.711668 0.423335 Na\n0.288333 0.288333 0.576665 Na\n0.576527 0.576528 0.153055 Ca\n0.423472 0.423473 0.846945 Ca\n0.855847 0.855849 0.711698 Ta\n0.000000 0.000000 0.000000 Ta\n0.144152 0.144152 0.288302 Ta\n0.069076 0.069076 0.138152 O\n0.790621 0.790623 0.581244 O\n0.930923 0.930925 0.861848 O\n0.633716 0.133716 0.267432 O\n0.133716 0.633716 0.267432 O\n0.366283 0.866285 0.732568 O\n0.866284 0.366285 0.732568 O\n0.209378 0.209378 0.418756 O\n0.500000 0.000000 0.000000 O\n-0.000000 0.500000 0.000000 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Na",
"Ca",
"Ta",
"O"
],
"chemical_system": "Ca-Na-O-Ta",
"density": 6.092030620873816,
"density_atomic": 0.07523525933880847,
"volume": 225.95788396825424,
"volume_molar": 8.004412841697496,
"formula_full": "Na2 Ca2 Ta3 O10",
"formula_reduced": "Na2Ca2Ta3O10",
"formula_anonymous": "A2B2C3D10",
"energy_above_hull": 2.918961849411765,
"spacegroup": 139
},
{
"id": "jvasp-53081",
"created_at": "2022-09-04T14:38:14.624231Z",
"updated_at": "2022-09-04T14:38:14.624249Z",
"structure_string": "Rb2 Cr1 Cl4\n1.0\n4.669425 -0.090566 -1.711367\n-0.537621 4.639256 -1.711367\n0.546785 0.601954 8.683030\nRb Cr Cl\n2 1 4\ndirect\n0.641415 0.641415 0.282987 Rb\n0.358585 0.358584 0.717012 Rb\n0.000000 0.000000 0.000000 Cr\n0.499999 -0.000000 -0.000000 Cl\n0.845264 0.845263 0.690319 Cl\n0.000000 0.500000 -0.000000 Cl\n0.154736 0.154736 0.309681 Cl\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Rb",
"Cr",
"Cl"
],
"chemical_system": "Cl-Cr-Rb",
"density": 3.067236520462114,
"density_atomic": 0.03544936089032693,
"volume": 197.4647729660506,
"volume_molar": 16.988009399185703,
"formula_full": "Rb2 Cr1 Cl4",
"formula_reduced": "Rb2CrCl4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.3043448100000003,
"spacegroup": 139
},
{
"id": "jvasp-17865",
"created_at": "2022-09-04T14:38:14.624164Z",
"updated_at": "2022-09-04T14:38:14.624192Z",
"structure_string": "Hf1 Sn1 Pt1\n1.0\n3.984868 -0.000000 2.300664\n1.328290 3.756969 2.300664\n0.000000 0.000000 4.601329\nHf Sn Pt\n1 1 1\ndirect\n0.250000 0.250000 0.249999 Hf\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.499999 Pt\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Hf",
"Sn",
"Pt"
],
"chemical_system": "Hf-Pt-Sn",
"density": 11.86670045732967,
"density_atomic": 0.04354982522415418,
"volume": 68.88661400037262,
"volume_molar": 13.828162866334353,
"formula_full": "Hf1 Sn1 Pt1",
"formula_reduced": "HfSnPt",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4209887,
"spacegroup": 216
}
]
}