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=159",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=157",
"results": [
{
"id": "jvasp-78929",
"created_at": "2022-09-04T14:36:33.578767Z",
"updated_at": "2022-09-04T14:36:33.578795Z",
"structure_string": "Co1 O2\n1.0\n2.823238 -0.000000 -0.000000\n-1.411619 2.444995 0.000000\n0.000000 0.000000 4.216094\nCo O\n1 2\ndirect\n0.000000 0.000000 -0.000000 Co\n0.666668 0.333334 0.779701 O\n0.333333 0.666668 0.220300 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Co",
"O"
],
"chemical_system": "Co-O",
"density": 5.188359558664132,
"density_atomic": 0.1030826330816711,
"volume": 29.10286544216558,
"volume_molar": 5.842051740402026,
"formula_full": "Co1 O2",
"formula_reduced": "CoO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0668959666666677,
"spacegroup": 164
},
{
"id": "jvasp-86248",
"created_at": "2022-09-04T14:36:19.215531Z",
"updated_at": "2022-09-04T14:36:19.215556Z",
"structure_string": "Nb2 I10\n1.0\n7.042229 -0.005882 -0.111834\n-3.426944 6.361124 -2.486079\n0.002807 0.015882 10.384801\nNb I\n2 10\ndirect\n0.107525 0.223512 0.223818 Nb\n0.892476 0.776488 0.776182 Nb\n0.871851 0.389183 0.149644 I\n0.750634 0.809122 0.046225 I\n0.317956 0.004136 0.250233 I\n0.682045 0.995863 0.749767 I\n0.249366 0.190877 0.953775 I\n0.128149 0.610816 0.850356 I\n0.463022 0.593807 0.337662 I\n0.924070 0.187831 0.443340 I\n0.536979 0.406192 0.662338 I\n0.075931 0.812168 0.556660 I\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Nb",
"I"
],
"chemical_system": "I-Nb",
"density": 5.192250310250554,
"density_atomic": 0.025790949092941287,
"volume": 465.27950393590885,
"volume_molar": 23.349822212041808,
"formula_full": "Nb2 I10",
"formula_reduced": "NbI5",
"formula_anonymous": "AB5",
"energy_above_hull": 0.644596795833333,
"spacegroup": 2
},
{
"id": "jvasp-18713",
"created_at": "2022-09-04T14:36:33.617961Z",
"updated_at": "2022-09-04T14:36:33.617977Z",
"structure_string": "Zr2 Ga4\n1.0\n3.825567 0.000000 -1.184995\n0.000000 4.139432 0.000000\n0.017549 0.000000 6.824272\nZr Ga\n2 4\ndirect\n0.649190 0.000000 0.298380 Zr\n0.350811 0.000000 0.701621 Zr\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.000000 Ga\n0.820692 0.500000 0.641384 Ga\n0.179309 0.500000 0.358616 Ga\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Ga"
],
"chemical_system": "Ga-Zr",
"density": 7.083232749007557,
"density_atomic": 0.05547694715191356,
"volume": 108.15303126846703,
"volume_molar": 10.855212965323165,
"formula_full": "Zr2 Ga4",
"formula_reduced": "ZrGa2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8332397166666672,
"spacegroup": 65
},
{
"id": "jvasp-63865",
"created_at": "2022-09-04T14:36:11.315697Z",
"updated_at": "2022-09-04T14:36:11.315731Z",
"structure_string": "Au4 Cl8\n1.0\n6.768245 0.157767 -0.024385\n0.626987 6.678119 0.057981\n2.230808 0.196529 6.745722\nAu Cl\n4 8\ndirect\n0.735979 0.516600 0.468807 Au\n0.264023 0.483401 0.531192 Au\n0.638224 0.234168 0.088535 Au\n0.361778 0.765833 0.911463 Au\n0.851675 0.219316 0.299217 Cl\n0.148327 0.780685 0.700782 Cl\n0.343269 0.181252 0.371909 Cl\n0.656733 0.818748 0.628090 Cl\n0.427367 0.258457 0.885335 Cl\n0.572635 0.741543 0.114663 Cl\n0.925312 0.287709 0.817431 Cl\n0.074690 0.712291 0.182568 Cl\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Au",
"Cl"
],
"chemical_system": "Au-Cl",
"density": 5.8424774801678785,
"density_atomic": 0.03940405908250351,
"volume": 304.53715377074775,
"volume_molar": 15.283046722143398,
"formula_full": "Au4 Cl8",
"formula_reduced": "AuCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1047585683333333,
"spacegroup": 2
},
{
"id": "jvasp-14889",
"created_at": "2022-09-04T14:36:33.701865Z",
"updated_at": "2022-09-04T14:36:33.701891Z",
"structure_string": "Ru2 F6\n1.0\n4.423608 0.013128 3.159199\n1.633029 4.111166 3.159199\n0.019280 0.013128 5.435850\nRu F\n2 6\ndirect\n0.500000 0.500001 0.500000 Ru\n0.000000 0.000000 0.000000 Ru\n0.750000 0.089158 0.410842 F\n0.089157 0.410843 0.750000 F\n0.589158 0.250001 0.910842 F\n0.910843 0.589159 0.249999 F\n0.250000 0.910844 0.589157 F\n0.410843 0.750001 0.089157 F\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ru",
"F"
],
"chemical_system": "F-Ru",
"density": 5.336154820847389,
"density_atomic": 0.0813210586712201,
"volume": 98.37550236948941,
"volume_molar": 7.405389032559735,
"formula_full": "Ru2 F6",
"formula_reduced": "RuF3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5844478368750001,
"spacegroup": 167
},
{
"id": "jvasp-93799",
"created_at": "2022-09-04T14:36:11.307216Z",
"updated_at": "2022-09-04T14:36:11.307237Z",
"structure_string": "Re2 N4\n1.0\n0.000000 0.000000 2.835179\n3.861840 2.867977 0.000000\n-3.861840 2.867977 0.000000\nRe N\n2 4\ndirect\n0.000000 0.000000 0.500000 Re\n0.000000 0.500000 0.000000 Re\n0.500000 0.312054 0.687947 N\n0.500000 0.687947 0.312054 N\n0.000000 0.886587 0.886587 N\n0.000000 0.113415 0.113415 N\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 11.328163256437172,
"density_atomic": 0.09553683081457218,
"volume": 62.803004337096176,
"volume_molar": 6.3034755378147285,
"formula_full": "Re2 N4",
"formula_reduced": "ReN2",
"formula_anonymous": "AB2",
"energy_above_hull": 5.165851499999999,
"spacegroup": 65
},
{
"id": "jvasp-78466",
"created_at": "2022-09-04T14:36:33.611562Z",
"updated_at": "2022-09-04T14:36:33.611583Z",
"structure_string": "Sc1 C1\n1.0\n2.871727 0.000000 -0.000000\n0.000000 2.871727 0.000000\n0.000000 0.000000 2.871727\nSc C\n1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500001 0.500001 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sc",
"C"
],
"chemical_system": "C-Sc",
"density": 3.9942940592050316,
"density_atomic": 0.08445017256661531,
"volume": 23.68260406362552,
"volume_molar": 7.130998761725044,
"formula_full": "Sc1 C1",
"formula_reduced": "ScC",
"formula_anonymous": "AB",
"energy_above_hull": 2.992752625,
"spacegroup": 221
},
{
"id": "jvasp-94299",
"created_at": "2022-09-04T14:35:56.340830Z",
"updated_at": "2022-09-04T14:35:56.340856Z",
"structure_string": "Tb2 Si4\n1.0\n-0.000000 -3.967298 0.000000\n-3.967218 0.000000 0.000000\n1.983610 1.983649 -7.483174\nTb Si\n2 4\ndirect\n0.625014 0.375014 0.750027 Tb\n0.374986 0.624986 0.249972 Tb\n0.043614 0.793615 0.587228 Si\n0.956386 0.206385 0.412771 Si\n0.206387 0.956388 0.912774 Si\n0.793613 0.043612 0.087225 Si\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tb",
"Si"
],
"chemical_system": "Si-Tb",
"density": 6.06520383982404,
"density_atomic": 0.05094300011246397,
"volume": 117.77869357427204,
"volume_molar": 11.821331187219561,
"formula_full": "Tb2 Si4",
"formula_reduced": "TbSi2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.109378533333333,
"spacegroup": 141
},
{
"id": "jvasp-90431",
"created_at": "2022-09-04T14:35:56.341520Z",
"updated_at": "2022-09-04T14:35:56.341550Z",
"structure_string": "Mn2 O6\n1.0\n2.729703 -3.043444 2.328299\n2.729703 3.043444 -2.328299\n-2.729703 3.043444 2.328299\nMn O\n2 6\ndirect\n0.000000 0.499999 0.499999 Mn\n0.000000 0.000000 0.000000 Mn\n0.799093 0.749999 0.549093 O\n0.200907 0.250000 0.450907 O\n0.500000 0.121110 0.121111 O\n0.000000 0.378889 0.878889 O\n-0.000000 0.621110 0.121110 O\n0.500000 0.878888 0.878889 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"O"
],
"chemical_system": "Mn-O",
"density": 4.41842980384629,
"density_atomic": 0.10339761752971206,
"volume": 77.37122180500089,
"volume_molar": 5.824254856036208,
"formula_full": "Mn2 O6",
"formula_reduced": "MnO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.591004435344828,
"spacegroup": 74
},
{
"id": "jvasp-103109",
"created_at": "2022-09-04T14:36:33.637474Z",
"updated_at": "2022-09-04T14:36:33.637499Z",
"structure_string": "Cr1 Ir1\n1.0\n2.689563 0.000000 0.000000\n-1.344781 2.329231 -0.000000\n0.000000 -0.000000 4.214318\nCr Ir\n1 1\ndirect\n0.666666 0.333333 0.000000 Cr\n0.333333 0.666667 0.500000 Ir\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cr",
"Ir"
],
"chemical_system": "Cr-Ir",
"density": 15.360185754111917,
"density_atomic": 0.07575449535096615,
"volume": 26.401073503745444,
"volume_molar": 7.949549042733072,
"formula_full": "Cr1 Ir1",
"formula_reduced": "CrIr",
"formula_anonymous": "AB",
"energy_above_hull": 3.0603442500000004,
"spacegroup": 187
},
{
"id": "jvasp-78996",
"created_at": "2022-09-04T14:36:34.124334Z",
"updated_at": "2022-09-04T14:36:34.124363Z",
"structure_string": "Zn3 Os1\n1.0\n-1.843569 1.843569 4.172063\n1.843569 -1.843569 4.172063\n1.843569 1.843569 -4.172063\nZn Os\n3 1\ndirect\n0.750000 0.249999 0.500001 Zn\n0.249999 0.750000 0.500001 Zn\n0.500001 0.500001 0.000000 Zn\n0.000000 0.000000 0.000000 Os\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zn",
"Os"
],
"chemical_system": "Os-Zn",
"density": 11.314116152691332,
"density_atomic": 0.07052293017856365,
"volume": 56.71914070887332,
"volume_molar": 8.539266228377032,
"formula_full": "Zn3 Os1",
"formula_reduced": "Zn3Os",
"formula_anonymous": "AB3",
"energy_above_hull": 0.33417905,
"spacegroup": 139
},
{
"id": "jvasp-101373",
"created_at": "2022-09-04T14:36:33.693391Z",
"updated_at": "2022-09-04T14:36:33.693415Z",
"structure_string": "Ho10 Si17\n1.0\n6.382073 -0.000000 -2.038943\n-0.992064 7.567335 -3.105250\n-0.005006 0.024101 10.992032\nHo Si\n10 17\ndirect\n0.564147 0.051937 0.600033 Ho\n0.761101 0.755203 0.000000 Ho\n0.564147 0.548095 0.600033 Ho\n0.368423 0.847962 0.200757 Ho\n0.964115 0.948062 0.399967 Ho\n0.761101 0.244796 0.000000 Ho\n0.964115 0.451904 0.399967 Ho\n0.167665 0.152038 0.799243 Ho\n0.368422 0.352794 0.200757 Ho\n0.167665 0.647205 0.799243 Ho\n0.431330 -0.000000 0.000000 Si\n0.242353 0.284670 0.569340 Si\n0.388268 0.500000 0.000000 Si\n0.080073 -0.000000 0.000000 Si\n0.702384 0.600277 0.200554 Si\n0.673013 0.715330 0.430660 Si\n0.296717 0.699542 0.399084 Si\n0.897632 0.300457 0.600915 Si\n0.714860 0.104407 0.208813 Si\n0.845377 0.878217 0.756436 Si\n0.501830 0.399723 0.799446 Si\n0.039462 0.581790 0.163580 Si\n0.177924 0.801001 0.602003 Si\n0.088941 0.121782 0.243564 Si\n0.506047 0.895593 0.791186 Si\n0.575921 0.198998 0.397997 Si\n0.875880 0.418210 0.836420 Si\n",
"nsites": 27,
"nelements": 2,
"elements": [
"Ho",
"Si"
],
"chemical_system": "Ho-Si",
"density": 6.646865803798916,
"density_atomic": 0.05081755522024664,
"volume": 531.3124545834646,
"volume_molar": 11.850512552010118,
"formula_full": "Ho10 Si17",
"formula_reduced": "Ho10Si17",
"formula_anonymous": "A10B17",
"energy_above_hull": 3.169431550617284,
"spacegroup": 44
}
]
}