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=331",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=329",
"results": [
{
"id": "jvasp-10792",
"created_at": "2022-09-04T14:38:11.399522Z",
"updated_at": "2022-09-04T14:38:11.399546Z",
"structure_string": "K2 Ho4 Cu2 S8\n1.0\n3.928993 0.000000 -0.000000\n-1.964497 6.666734 -0.000000\n-0.000000 0.000000 13.641571\nK Ho Cu S\n2 4 2 8\ndirect\n0.889322 0.778646 0.250000 K\n0.110677 0.221354 0.750000 K\n0.365929 0.731859 0.936442 Ho\n0.634069 0.268141 0.436442 Ho\n0.365929 0.731859 0.563558 Ho\n0.634069 0.268141 0.063558 Ho\n0.837966 0.675932 0.750000 Cu\n0.162033 0.324067 0.250000 Cu\n0.000000 0.000000 0.500000 S\n0.000000 0.000000 0.000000 S\n0.264527 0.529057 0.110749 S\n0.735471 0.470943 0.889251 S\n0.433988 0.867977 0.750000 S\n0.264527 0.529057 0.389251 S\n0.566010 0.132022 0.250000 S\n0.735471 0.470943 0.610749 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"K",
"Ho",
"Cu",
"S"
],
"chemical_system": "Cu-Ho-K-S",
"density": 5.21196122431129,
"density_atomic": 0.04477764125454955,
"volume": 357.32118869424255,
"volume_molar": 13.448990592795306,
"formula_full": "K2 Ho4 Cu2 S8",
"formula_reduced": "KHo2CuS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.0887711979166663,
"spacegroup": 63
},
{
"id": "jvasp-59202",
"created_at": "2022-09-04T14:38:11.414907Z",
"updated_at": "2022-09-04T14:38:11.414927Z",
"structure_string": "Li2 Mn2 P4 O14\n1.0\n-5.170976 0.025757 -0.020399\n0.640064 6.900309 0.053779\n-0.184159 -3.090800 -7.384037\nLi Mn P O\n2 2 4 14\ndirect\n0.704607 0.147504 0.988784 Li\n0.265439 0.931254 0.441082 Li\n0.790165 0.756500 0.728339 Mn\n0.225366 0.220800 0.270377 Mn\n0.236884 0.120684 0.830404 P\n0.284915 0.458976 0.696404 P\n0.745789 0.872514 0.171374 P\n0.721117 0.530703 0.302659 P\n0.328883 0.145744 0.020438 O\n0.411631 0.994174 0.682918 O\n0.176916 0.275015 0.521347 O\n0.579266 0.504191 0.677504 O\n0.544860 0.990153 0.301823 O\n0.692226 0.858577 0.978799 O\n0.945791 0.045992 0.795739 O\n0.853147 0.699853 0.473908 O\n0.863721 0.332679 0.214695 O\n0.253003 0.362661 0.850015 O\n0.134795 0.650502 0.762415 O\n0.730766 0.630759 0.151260 O\n0.031167 0.953539 0.229262 O\n0.430013 0.484728 0.332117 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 2.9807363598740144,
"density_atomic": 0.08373020511551249,
"volume": 262.7486696067357,
"volume_molar": 7.192315785793165,
"formula_full": "Li2 Mn2 P4 O14",
"formula_reduced": "LiMnP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.8539484310344827,
"spacegroup": 1
},
{
"id": "jvasp-109888",
"created_at": "2022-09-04T14:38:11.428156Z",
"updated_at": "2022-09-04T14:38:11.428179Z",
"structure_string": "Rb2 Lu1 Ag1 Cl6\n1.0\n6.428489 -0.000000 3.711490\n2.142830 6.060837 3.711490\n-0.000000 -0.000000 7.422979\nRb Lu Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Ag\n0.756205 0.243796 0.243795 Cl\n0.243796 0.243796 0.756205 Cl\n0.243795 0.756205 0.756204 Cl\n0.243795 0.756205 0.243795 Cl\n0.756205 0.243796 0.756205 Cl\n0.756205 0.756205 0.243795 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Lu",
"Ag",
"Cl"
],
"chemical_system": "Ag-Cl-Lu-Rb",
"density": 3.8266805757388305,
"density_atomic": 0.03457643861175291,
"volume": 289.2142858403262,
"volume_molar": 17.416891391333195,
"formula_full": "Rb2 Lu1 Ag1 Cl6",
"formula_reduced": "Rb2LuAgCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-9331",
"created_at": "2022-09-04T14:38:11.433261Z",
"updated_at": "2022-09-04T14:38:11.433292Z",
"structure_string": "Y1 Re1 W2 O8\n1.0\n-5.043371 0.046708 -0.041694\n-0.306702 -5.820685 -0.020259\n2.173297 2.235459 5.311744\nY Re W O\n1 1 2 8\ndirect\n0.525188 0.276414 0.900615 Y\n0.024427 0.776065 0.900033 Re\n0.280719 0.603352 0.418521 W\n0.768746 0.950885 0.382307 W\n0.324289 0.316474 0.181190 O\n0.259033 0.540101 0.694889 O\n0.367986 0.791452 0.203874 O\n0.173753 0.969504 0.579951 O\n0.788984 0.012264 0.104455 O\n0.728064 0.237423 0.621068 O\n0.681690 0.762886 0.596454 O\n0.877016 0.584686 0.220546 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Y",
"Re",
"W",
"O"
],
"chemical_system": "O-Re-W-Y",
"density": 8.242805595717687,
"density_atomic": 0.07728091099266296,
"volume": 155.27767266019004,
"volume_molar": 7.7925333470405675,
"formula_full": "Y1 Re1 W2 O8",
"formula_reduced": "YRe(WO4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 4.393930954166667,
"spacegroup": 2
},
{
"id": "jvasp-46174",
"created_at": "2022-09-04T14:38:11.515511Z",
"updated_at": "2022-09-04T14:38:11.515543Z",
"structure_string": "Rb1 Li7 Ni2 O6\n1.0\n3.646610 -0.002704 0.001012\n-1.819665 4.978325 -0.022224\n-0.003087 -0.467543 9.859651\nRb Li Ni O\n1 7 2 6\ndirect\n0.010796 0.022222 0.007649 Rb\n0.180018 0.360663 0.259828 Li\n0.744831 0.490239 0.096001 Li\n0.223400 0.447408 0.580649 Li\n0.742768 0.486141 0.410717 Li\n0.277015 0.554565 0.895751 Li\n0.825227 0.650953 0.724716 Li\n0.468801 0.937791 0.534675 Li\n0.576277 0.153054 0.755331 Ni\n0.432956 0.866513 0.263071 Ni\n0.613955 0.228543 0.240846 O\n0.657661 0.315909 0.586572 O\n0.709531 0.419612 0.891018 O\n0.316449 0.633495 0.108477 O\n0.321686 0.643982 0.409531 O\n0.391233 0.782949 0.723095 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Rb",
"density": 3.224778393223921,
"density_atomic": 0.08943210315745424,
"volume": 178.90667260536617,
"volume_molar": 6.733757283329693,
"formula_full": "Rb1 Li7 Ni2 O6",
"formula_reduced": "RbLi7(NiO3)2",
"formula_anonymous": "AB2C6D7",
"energy_above_hull": 1.4924516125,
"spacegroup": 8
},
{
"id": "jvasp-51671",
"created_at": "2022-09-04T14:38:11.532409Z",
"updated_at": "2022-09-04T14:38:11.532438Z",
"structure_string": "Li2 P2 H4 O4\n1.0\n4.483213 2.615727 -1.522775\n-4.483213 2.615727 1.522775\n-0.125759 0.000000 6.420804\nLi P H O\n2 2 4 4\ndirect\n0.250240 0.250240 0.000000 Li\n0.749761 0.749761 0.000000 Li\n0.187121 0.812880 0.718777 P\n0.812880 0.187121 0.281222 P\n0.933518 0.638448 0.573856 H\n0.361553 0.066483 0.573856 H\n0.066483 0.361553 0.426144 H\n0.638448 0.933518 0.426144 H\n0.086873 0.913128 0.859820 O\n0.913127 0.086874 0.140179 O\n0.356294 0.643707 0.833089 O\n0.643707 0.356294 0.166911 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"P",
"H",
"O"
],
"chemical_system": "H-Li-O-P",
"density": 1.5969210994130805,
"density_atomic": 0.08021930975026537,
"volume": 149.5899184044064,
"volume_molar": 7.5070962075687495,
"formula_full": "Li2 P2 H4 O4",
"formula_reduced": "LiP(HO)2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 2.280347083333333,
"spacegroup": 12
},
{
"id": "jvasp-12694",
"created_at": "2022-09-04T14:38:11.546768Z",
"updated_at": "2022-09-04T14:38:11.546784Z",
"structure_string": "V2 Fe2 H4 O10\n1.0\n5.254026 -0.009432 -0.002749\n-1.604918 5.364483 -0.039290\n-0.562001 -1.496149 6.213884\nV Fe H O\n2 2 4 10\ndirect\n0.256105 0.618542 0.757081 V\n0.743895 0.381458 0.242918 V\n0.627726 0.206121 0.692112 Fe\n0.372274 0.793878 0.307888 Fe\n0.078197 0.116071 0.701500 H\n0.921804 0.883929 0.298499 H\n0.850941 0.851077 0.705181 H\n0.149059 0.148923 0.294818 H\n0.907005 0.519565 0.730478 O\n0.092996 0.480435 0.269521 O\n0.903018 0.041124 0.749227 O\n0.365831 0.871869 0.613286 O\n0.642060 0.644410 0.347581 O\n0.398766 0.740198 0.018586 O\n0.601234 0.259802 0.981413 O\n0.096982 0.958876 0.250772 O\n0.357941 0.355590 0.652418 O\n0.634170 0.128131 0.386713 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"V",
"Fe",
"H",
"O"
],
"chemical_system": "Fe-H-O-V",
"density": 3.5886756701203035,
"density_atomic": 0.10302130775762211,
"volume": 174.72113674142577,
"volume_molar": 5.84552932891152,
"formula_full": "V2 Fe2 H4 O10",
"formula_reduced": "VFeH2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 3.1020085777777777,
"spacegroup": 2
},
{
"id": "jvasp-12710",
"created_at": "2022-09-04T14:38:11.554902Z",
"updated_at": "2022-09-04T14:38:11.554929Z",
"structure_string": "Ni2 H4 Se2 O10\n1.0\n5.059000 -0.039829 -1.610594\n-1.291343 4.891574 -1.610594\n-0.009740 -0.012543 7.555105\nNi H Se O\n2 4 2 10\ndirect\n0.000000 0.000000 0.500000 Ni\n0.500000 0.499999 0.000000 Ni\n0.632126 0.031198 0.199372 H\n0.468802 0.867873 0.300630 H\n0.367874 0.968801 0.800630 H\n0.531198 0.132126 0.699372 H\n0.913845 0.586155 0.750001 Se\n0.086155 0.413845 0.250000 Se\n0.195470 0.293653 0.432011 O\n0.809473 0.239540 0.652069 O\n0.739541 0.309473 0.152069 O\n0.190527 0.760459 0.347932 O\n0.375576 0.124424 0.750001 O\n0.624424 0.875575 0.250001 O\n0.793654 0.695469 0.932012 O\n0.804531 0.706346 0.567991 O\n0.206347 0.304530 0.067990 O\n0.260460 0.690527 0.847933 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ni",
"H",
"Se",
"O"
],
"chemical_system": "H-Ni-O-Se",
"density": 3.9144541273984186,
"density_atomic": 0.09658311865486338,
"volume": 186.36797248515458,
"volume_molar": 6.235189797007822,
"formula_full": "Ni2 H4 Se2 O10",
"formula_reduced": "NiH2SeO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.4902170296296298,
"spacegroup": 15
},
{
"id": "jvasp-51677",
"created_at": "2022-09-04T14:38:11.824637Z",
"updated_at": "2022-09-04T14:38:11.824670Z",
"structure_string": "Sr4 H8 Cl8 O4\n1.0\n4.045157 0.000000 0.000000\n0.000000 8.110961 0.000000\n0.000000 0.000000 12.091593\nSr H Cl O\n4 8 8 4\ndirect\n0.750000 0.288208 0.483348 Sr\n0.750000 0.788208 0.016651 Sr\n0.250000 0.711792 0.516651 Sr\n0.250000 0.211792 -0.016651 Sr\n0.750000 0.100981 0.245094 H\n0.250000 0.399019 0.745094 H\n0.250000 0.899019 0.754906 H\n0.750000 0.600981 0.254906 H\n0.750000 0.058244 0.832062 H\n0.250000 0.441756 0.332063 H\n0.250000 0.941756 0.167937 H\n0.750000 0.558244 0.667937 H\n0.250000 0.257289 0.694170 Cl\n0.250000 0.757288 0.805830 Cl\n0.750000 0.742711 0.305830 Cl\n0.750000 0.242711 0.194170 Cl\n0.250000 0.542898 0.114802 Cl\n0.250000 0.042898 0.385198 Cl\n0.750000 0.457102 0.885197 Cl\n0.750000 -0.042898 0.614802 Cl\n0.750000 0.555918 0.587006 O\n0.250000 0.444082 0.412994 O\n0.250000 0.944082 0.087006 O\n0.750000 0.055918 0.912993 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sr",
"H",
"Cl",
"O"
],
"chemical_system": "Cl-H-O-Sr",
"density": 2.9557258112512392,
"density_atomic": 0.06049507590339682,
"volume": 396.7265044567436,
"volume_molar": 9.954761887755323,
"formula_full": "Sr4 H8 Cl8 O4",
"formula_reduced": "SrH2Cl2O",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 1.064676324166667,
"spacegroup": 62
},
{
"id": "jvasp-42542",
"created_at": "2022-09-04T14:38:11.837587Z",
"updated_at": "2022-09-04T14:38:11.837604Z",
"structure_string": "Li1 Fe3 O3 F4\n1.0\n4.030445 2.326979 2.100034\n-4.030445 2.326979 2.100034\n-0.000000 -4.653958 2.100034\nLi Fe O F\n1 3 3 4\ndirect\n0.926377 0.926377 0.926377 Li\n0.172638 0.529746 0.529746 Fe\n0.529745 0.529745 0.172638 Fe\n0.529746 0.172638 0.529746 Fe\n0.397955 0.767810 0.397955 O\n0.397955 0.397955 0.767810 O\n0.767810 0.397955 0.397955 O\n0.203320 0.828649 0.828649 F\n0.230078 0.230078 0.230078 F\n0.828649 0.828649 0.203320 F\n0.828649 0.203320 0.828649 F\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 4.19395301700024,
"density_atomic": 0.09308284434120824,
"volume": 118.17430030047164,
"volume_molar": 6.469657005672277,
"formula_full": "Li1 Fe3 O3 F4",
"formula_reduced": "LiFe3O3F4",
"formula_anonymous": "AB3C3D4",
"energy_above_hull": 1.7823125572727272,
"spacegroup": 160
},
{
"id": "jvasp-98617",
"created_at": "2022-09-04T14:38:11.900754Z",
"updated_at": "2022-09-04T14:38:11.900780Z",
"structure_string": "K12 U4 O8 F20\n1.0\n8.309203 0.000002 -3.740145\n-1.683518 8.136869 -3.740143\n0.000260 0.000318 11.100623\nK U O F\n12 4 8 20\ndirect\n0.125000 0.375000 0.250000 K\n0.874999 0.625000 0.750000 K\n0.625000 0.875000 0.250000 K\n0.375000 0.125000 0.750000 K\n0.229285 -0.000851 0.029259 K\n0.030109 0.729285 0.529259 K\n0.499149 0.299974 0.529259 K\n0.799973 0.530109 0.029259 K\n0.770715 0.000851 0.970741 K\n0.969890 0.270715 0.470742 K\n0.500851 0.700026 0.470742 K\n0.200026 0.469891 0.970741 K\n0.396694 0.646694 0.793388 U\n0.603306 0.353306 0.206612 U\n0.853306 0.103306 0.706612 U\n0.146694 0.896694 0.293388 U\n0.653148 0.154710 0.204990 O\n0.050280 0.153148 0.704989 O\n0.654709 0.051841 0.704990 O\n0.551841 0.550280 0.204990 O\n0.346851 0.845291 0.795011 O\n0.949720 0.846852 0.295011 O\n0.345290 0.948159 0.295011 O\n0.448159 0.449720 0.795011 O\n0.019852 0.769852 0.039704 F\n0.126682 0.545099 0.713725 F\n0.168625 0.626682 0.213725 F\n0.045099 0.087043 0.213725 F\n0.587042 0.668626 0.713725 F\n0.269852 0.519852 0.539704 F\n0.873318 0.454901 0.286276 F\n0.954900 0.912957 0.786276 F\n0.351396 0.727445 0.994000 F\n0.266555 0.851397 0.494000 F\n0.227444 0.142604 0.494000 F\n0.642603 0.766556 0.994000 F\n0.648603 0.272555 0.006000 F\n0.733444 0.148603 0.506000 F\n0.412957 0.331374 0.286275 F\n0.357396 0.233444 0.006000 F\n0.980147 0.230148 0.960296 F\n0.730147 0.480148 0.460296 F\n0.831374 0.373318 0.786276 F\n0.772555 0.857396 0.506000 F\n",
"nsites": 44,
"nelements": 4,
"elements": [
"K",
"U",
"O",
"F"
],
"chemical_system": "F-K-O-U",
"density": 4.268389044484807,
"density_atomic": 0.05862423010687158,
"volume": 750.5429055492634,
"volume_molar": 10.272443235538747,
"formula_full": "K12 U4 O8 F20",
"formula_reduced": "K3UO2F5",
"formula_anonymous": "AB2C3D5",
"energy_above_hull": 0.5014753102272729,
"spacegroup": 88
},
{
"id": "jvasp-86029",
"created_at": "2022-09-04T14:38:11.988557Z",
"updated_at": "2022-09-04T14:38:11.988580Z",
"structure_string": "Na2 Ca2 V2 O8\n1.0\n5.528233 0.017025 -0.000000\n-2.348746 5.004502 0.000000\n-0.000000 0.000000 7.130291\nNa Ca V O\n2 2 2 8\ndirect\n0.499999 0.499999 0.000000 Na\n0.499999 0.499999 0.500000 Na\n0.819206 0.180792 0.250000 Ca\n0.180792 0.819207 0.750000 Ca\n0.144891 0.855108 0.250000 V\n0.855107 0.144891 0.750000 V\n0.258839 0.199850 0.250000 O\n0.252518 0.747481 0.053675 O\n0.800149 0.741160 0.250000 O\n0.747480 0.252518 0.553675 O\n0.199849 0.258839 0.750000 O\n0.252518 0.747481 0.446325 O\n0.747480 0.252518 0.946325 O\n0.741159 0.800149 0.750000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Na",
"Ca",
"V",
"O"
],
"chemical_system": "Ca-Na-O-V",
"density": 2.992499839643251,
"density_atomic": 0.07086737009875123,
"volume": 197.5521312628292,
"volume_molar": 8.497762442162529,
"formula_full": "Na2 Ca2 V2 O8",
"formula_reduced": "NaCaVO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.7034239457142863,
"spacegroup": 63
}
]
}