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=-volume&page=364",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=362",
"results": [
{
"id": "jvasp-20810",
"created_at": "2022-09-04T14:37:41.533963Z",
"updated_at": "2022-09-04T14:37:41.533985Z",
"structure_string": "Dy10 Si6\n1.0\n4.217800 -7.305444 -0.000000\n4.217800 7.305444 0.000000\n-0.000000 -0.000000 6.343642\nDy Si\n10 6\ndirect\n0.000000 0.756997 0.750000 Dy\n0.000000 0.243003 0.250000 Dy\n0.756997 0.756997 0.250000 Dy\n0.756997 0.000000 0.750000 Dy\n0.243003 0.243003 0.750000 Dy\n0.243003 0.000000 0.250000 Dy\n0.666667 0.333333 0.000000 Dy\n0.333333 0.666667 0.500000 Dy\n0.333333 0.666667 0.000000 Dy\n0.666667 0.333333 0.500000 Dy\n0.394025 0.000000 0.750000 Si\n0.394025 0.394025 0.250000 Si\n0.000000 0.605975 0.250000 Si\n0.000000 0.394025 0.750000 Si\n0.605975 0.605975 0.750000 Si\n0.605975 0.000000 0.250000 Si\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Dy",
"Si"
],
"chemical_system": "Dy-Si",
"density": 7.618199937714187,
"density_atomic": 0.04092783035626057,
"volume": 390.93203477258214,
"volume_molar": 14.714048381210652,
"formula_full": "Dy10 Si6",
"formula_reduced": "Dy5Si3",
"formula_anonymous": "A3B5",
"energy_above_hull": 2.3081022875,
"spacegroup": 193
},
{
"id": "jvasp-99221",
"created_at": "2022-09-04T14:36:41.110565Z",
"updated_at": "2022-09-04T14:36:41.110586Z",
"structure_string": "Cd4 H8 Se4 O16\n1.0\n12.986013 0.000000 0.000000\n0.000000 5.969852 0.000000\n0.000000 -0.000000 5.042563\nCd H Se O\n4 8 4 16\ndirect\n0.774368 0.250000 0.085226 Cd\n0.274368 0.250000 0.414774 Cd\n0.225632 0.750000 0.914774 Cd\n0.725632 0.750000 0.585225 Cd\n0.891882 0.118179 0.537017 H\n0.391882 0.381821 0.962982 H\n0.108118 0.618179 0.462982 H\n0.608117 0.881821 0.037017 H\n0.108118 0.881821 0.462982 H\n0.608117 0.618179 0.037017 H\n0.891882 0.381821 0.537017 H\n0.391882 0.118179 0.962982 H\n0.086228 0.250000 0.005261 Se\n0.586228 0.250000 0.494738 Se\n0.913772 0.750000 -0.005261 Se\n0.413772 0.750000 0.505261 Se\n0.398453 0.250000 0.082412 O\n0.898453 0.250000 0.417588 O\n0.345189 0.531119 0.661076 O\n0.845189 0.968880 0.838923 O\n0.654811 0.031120 0.338924 O\n0.154811 0.468880 0.161076 O\n0.654811 0.468880 0.338924 O\n0.154811 0.031120 0.161076 O\n0.845189 0.531119 0.838923 O\n0.867695 0.750000 0.306381 O\n0.367695 0.750000 0.193618 O\n0.132305 0.250000 0.693618 O\n0.632305 0.250000 0.806381 O\n0.101547 0.750000 0.582412 O\n0.345189 0.968880 0.661076 O\n0.601547 0.750000 0.917588 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Cd",
"H",
"Se",
"O"
],
"chemical_system": "Cd-H-O-Se",
"density": 4.373213841117909,
"density_atomic": 0.08185764529048069,
"volume": 390.9225569150511,
"volume_molar": 7.35684582500484,
"formula_full": "Cd4 H8 Se4 O16",
"formula_reduced": "CdH2SeO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.9487446395833328,
"spacegroup": 62
},
{
"id": "jvasp-113001",
"created_at": "2022-09-04T14:38:45.352261Z",
"updated_at": "2022-09-04T14:38:45.352287Z",
"structure_string": "Tm10 Sb2 Pt4\n1.0\n6.809269 -0.100791 -5.224071\n-1.716026 6.590262 -5.224071\n0.079106 0.100791 8.582005\nTm Sb Pt\n10 2 4\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 -0.000000 Tm\n0.795175 0.295174 0.811012 Tm\n0.204826 0.704826 0.188987 Tm\n0.484160 0.984161 0.188987 Tm\n0.295174 0.484161 0.500000 Tm\n0.015839 0.204826 0.500000 Tm\n0.515840 0.015839 0.811012 Tm\n0.704826 0.515839 0.500000 Tm\n0.984161 0.795174 0.500000 Tm\n0.250000 0.250000 -0.000000 Sb\n0.750000 0.750000 -0.000000 Sb\n0.140519 0.640519 0.781039 Pt\n0.859481 0.359481 0.218960 Pt\n0.640519 0.859480 0.500000 Pt\n0.359481 0.140519 0.500000 Pt\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tm",
"Sb",
"Pt"
],
"chemical_system": "Pt-Sb-Tm",
"density": 11.526049522450036,
"density_atomic": 0.04093265001470377,
"volume": 390.8860040640541,
"volume_molar": 14.71231585992291,
"formula_full": "Tm10 Sb2 Pt4",
"formula_reduced": "Tm5SbPt2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.84850626875,
"spacegroup": 140
},
{
"id": "jvasp-27060",
"created_at": "2022-09-04T14:38:34.674315Z",
"updated_at": "2022-09-04T14:38:34.674336Z",
"structure_string": "Hf10 Sn8\n1.0\n4.373722 -7.575508 -0.000000\n4.373722 7.575508 -0.000000\n0.000000 -0.000000 5.898696\nHf Sn\n10 8\ndirect\n0.333333 0.666667 0.000000 Hf\n0.717009 -0.000000 0.750001 Hf\n-0.000000 0.282991 0.250000 Hf\n-0.000000 0.717009 0.750001 Hf\n0.282991 0.282991 0.750001 Hf\n0.717009 0.717009 0.250000 Hf\n0.333333 0.666667 0.500000 Hf\n0.666667 0.333333 0.000000 Hf\n0.666667 0.333333 0.500000 Hf\n0.282991 -0.000000 0.250000 Hf\n0.385482 0.385482 0.250000 Sn\n0.000000 0.000000 0.000000 Sn\n0.000000 0.000000 0.500000 Sn\n0.614518 -0.000000 0.250000 Sn\n0.614518 0.614518 0.750001 Sn\n-0.000000 0.385482 0.750001 Sn\n-0.000000 0.614518 0.250000 Sn\n0.385482 -0.000000 0.750001 Sn\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Hf",
"Sn"
],
"chemical_system": "Hf-Sn",
"density": 11.616914259920406,
"density_atomic": 0.04604935573641388,
"volume": 390.8849475122268,
"volume_molar": 13.077578749354677,
"formula_full": "Hf10 Sn8",
"formula_reduced": "Hf5Sn4",
"formula_anonymous": "A4B5",
"energy_above_hull": 3.781894644444445,
"spacegroup": 193
},
{
"id": "jvasp-33809",
"created_at": "2022-09-04T14:38:10.851137Z",
"updated_at": "2022-09-04T14:38:10.851147Z",
"structure_string": "Pm2 I6\n1.0\n10.495414 -0.000000 0.000000\n-5.247706 9.089295 -0.000000\n-0.000000 -0.000000 4.096578\nPm I\n2 6\ndirect\n0.333332 0.666665 0.749999 Pm\n0.666667 0.333333 0.250000 Pm\n0.204045 0.408092 0.249999 I\n0.591906 0.795953 0.249999 I\n0.204044 0.795953 0.249999 I\n0.795954 0.591908 0.750000 I\n0.408091 0.204046 0.750000 I\n0.795953 0.204046 0.750000 I\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pm",
"I"
],
"chemical_system": "I-Pm",
"density": 4.467629465927094,
"density_atomic": 0.02047099655809371,
"volume": 390.7968025541485,
"volume_molar": 29.417916919237623,
"formula_full": "Pm2 I6",
"formula_reduced": "PmI3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-10710",
"created_at": "2022-09-04T14:37:20.129300Z",
"updated_at": "2022-09-04T14:37:20.129329Z",
"structure_string": "Rb2 Sm4 Cu2 S8\n1.0\n4.039956 0.000000 0.000000\n-2.019978 6.945563 0.000000\n0.000000 -0.000000 13.923292\nRb Sm Cu S\n2 4 2 8\ndirect\n0.892622 0.785243 0.250000 Rb\n0.107378 0.214756 0.750000 Rb\n0.365744 0.731488 0.938115 Sm\n0.634256 0.268511 0.438115 Sm\n0.365744 0.731488 0.561885 Sm\n0.634256 0.268511 0.061885 Sm\n0.836144 0.672288 0.750000 Cu\n0.163856 0.327712 0.250000 Cu\n0.000000 0.000000 0.500000 S\n0.000000 0.000000 0.000000 S\n0.572928 0.145854 0.250000 S\n0.427073 0.854145 0.750000 S\n0.261634 0.523268 0.388453 S\n0.738366 0.476732 0.888453 S\n0.738366 0.476732 0.611547 S\n0.261634 0.523268 0.111547 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"Sm",
"Cu",
"S"
],
"chemical_system": "Cu-Rb-S-Sm",
"density": 4.913333591514718,
"density_atomic": 0.04095377701167484,
"volume": 390.6843560592427,
"volume_molar": 14.70472615574199,
"formula_full": "Rb2 Sm4 Cu2 S8",
"formula_reduced": "RbSm2CuS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.1278810249999998,
"spacegroup": 63
},
{
"id": "jvasp-88423",
"created_at": "2022-09-04T14:35:55.560782Z",
"updated_at": "2022-09-04T14:35:55.560810Z",
"structure_string": "Pb8 O4 F8\n1.0\n5.767839 -0.000000 0.000000\n-0.000000 8.229646 0.000000\n0.000000 0.000000 8.229646\nPb O F\n8 4 8\ndirect\n0.060532 0.250000 0.025250 Pb\n0.560532 0.025250 0.250000 Pb\n0.060532 0.250000 0.474750 Pb\n0.939468 0.750000 0.974750 Pb\n0.939468 0.750000 0.525251 Pb\n0.439468 0.525251 0.750000 Pb\n0.439468 0.974750 0.750000 Pb\n0.560532 0.474750 0.250000 Pb\n0.161934 0.750000 0.750000 O\n0.338066 0.250000 0.250000 O\n0.838066 0.250000 0.250000 O\n0.661934 0.750000 0.750000 O\n0.750000 0.039954 0.960046 F\n0.750000 0.039954 0.539955 F\n0.250000 0.539955 0.460046 F\n0.250000 0.539955 0.039954 F\n0.250000 0.960046 0.460046 F\n0.750000 0.460046 0.539955 F\n0.250000 0.960046 0.039954 F\n0.750000 0.460046 0.960046 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Pb",
"O",
"F"
],
"chemical_system": "F-O-Pb",
"density": 7.964289164932275,
"density_atomic": 0.051198184107602636,
"volume": 390.6388546509038,
"volume_molar": 11.762410845164618,
"formula_full": "Pb8 O4 F8",
"formula_reduced": "Pb2OF2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.1555431409999997,
"spacegroup": 137
},
{
"id": "jvasp-45301",
"created_at": "2022-09-04T14:38:35.194622Z",
"updated_at": "2022-09-04T14:38:35.194645Z",
"structure_string": "Rb6 Ti2 F14\n1.0\n8.080440 0.000000 0.000000\n0.000000 8.080440 0.000000\n0.000000 0.000000 5.982473\nRb Ti F\n6 2 14\ndirect\n0.188986 0.688986 0.500000 Rb\n0.688986 0.811014 0.500000 Rb\n0.311014 0.188986 0.500000 Rb\n0.811014 0.311014 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Rb\n0.000000 0.500000 0.000000 Ti\n0.500000 0.000000 0.000000 Ti\n0.334787 0.165213 0.000000 F\n0.834787 0.334787 0.000000 F\n0.500000 0.500000 0.500000 F\n0.000000 0.000000 0.500000 F\n0.614611 0.114611 0.227568 F\n0.114611 0.385389 0.227568 F\n0.114611 0.385389 0.772432 F\n0.385389 0.885389 0.227568 F\n0.885389 0.614611 0.772432 F\n0.665213 0.834787 0.000000 F\n0.614611 0.114611 0.772432 F\n0.385389 0.885389 0.772432 F\n0.885389 0.614611 0.227568 F\n0.165213 0.665213 0.000000 F\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Rb",
"Ti",
"F"
],
"chemical_system": "F-Rb-Ti",
"density": 3.717639760765164,
"density_atomic": 0.056321201874417345,
"volume": 390.6166642014259,
"volume_molar": 10.692493341012,
"formula_full": "Rb6 Ti2 F14",
"formula_reduced": "Rb3TiF7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 0.0,
"spacegroup": 127
},
{
"id": "jvasp-99279",
"created_at": "2022-09-04T14:35:44.746553Z",
"updated_at": "2022-09-04T14:35:44.746581Z",
"structure_string": "Na2 Ca8 B6 O18\n1.0\n6.486982 0.000000 -0.000000\n-3.243492 5.612888 -0.000000\n-0.000000 -0.000000 10.727816\nNa Ca B O\n2 8 6 18\ndirect\n0.228620 0.151781 0.250000 Na\n0.076839 0.848219 0.750000 Na\n0.719750 -0.000000 0.000000 Ca\n0.293979 0.700049 0.250000 Ca\n0.593930 0.299951 0.750000 Ca\n0.863694 0.571181 0.027615 Ca\n0.719750 -0.000000 0.500000 Ca\n0.863694 0.571181 0.472385 Ca\n0.292514 0.428819 0.972385 Ca\n0.292514 0.428819 0.527615 Ca\n0.607572 0.756615 0.750000 B\n0.701272 0.658833 0.250000 B\n0.042439 0.341167 0.750000 B\n0.294697 -0.000000 0.000000 B\n0.850957 0.243386 0.250000 B\n0.294697 -0.000000 0.500000 B\n0.938557 0.723784 0.250000 O\n0.663339 0.678999 0.639114 O\n0.504203 0.208108 0.528091 O\n0.576299 0.621653 0.138800 O\n0.609414 0.094781 0.250000 O\n0.296096 0.791893 0.028091 O\n0.214773 0.276217 0.750000 O\n0.984340 0.321002 0.360887 O\n0.082826 -0.000000 0.500000 O\n0.984340 0.321002 0.139113 O\n0.504203 0.208108 0.971909 O\n0.663339 0.678999 0.860887 O\n0.954646 0.378348 0.638800 O\n0.576299 0.621653 0.361200 O\n0.296096 0.791893 0.471909 O\n0.954646 0.378348 0.861200 O\n0.082826 -0.000000 0.000000 O\n0.514633 0.905219 0.750000 O\n",
"nsites": 34,
"nelements": 4,
"elements": [
"Na",
"Ca",
"B",
"O"
],
"chemical_system": "B-Ca-Na-O",
"density": 3.0585430951458963,
"density_atomic": 0.08704393817116853,
"volume": 390.60732676341365,
"volume_molar": 6.918506775460565,
"formula_full": "Na2 Ca8 B6 O18",
"formula_reduced": "NaCa4(BO3)3",
"formula_anonymous": "AB3C4D9",
"energy_above_hull": 2.2303705841176464,
"spacegroup": 40
},
{
"id": "jvasp-57678",
"created_at": "2022-09-04T14:38:35.261572Z",
"updated_at": "2022-09-04T14:38:35.261598Z",
"structure_string": "Tb8 Sb6\n1.0\n7.519363 -0.000000 -2.658496\n-3.759681 6.511959 -2.658496\n-0.000000 -0.000000 7.975488\nTb Sb\n8 6\ndirect\n0.355662 0.500000 -0.000000 Tb\n0.644338 0.644339 0.644338 Tb\n0.500000 0.000000 0.355661 Tb\n0.000000 0.355662 0.500000 Tb\n0.500000 0.000000 0.855662 Tb\n0.000000 0.855662 0.500000 Tb\n0.855661 0.500000 -0.000001 Tb\n0.144338 0.144338 0.144338 Tb\n0.750000 0.875000 0.124999 Sb\n0.625000 0.375000 0.250000 Sb\n0.875000 0.125000 0.750000 Sb\n0.125000 0.750000 0.875000 Sb\n0.375000 0.250000 0.625000 Sb\n0.250000 0.625000 0.375000 Sb\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Tb",
"Sb"
],
"chemical_system": "Sb-Tb",
"density": 8.512460823999746,
"density_atomic": 0.03584908382880968,
"volume": 390.52601921026144,
"volume_molar": 16.798590415190418,
"formula_full": "Tb8 Sb6",
"formula_reduced": "Tb4Sb3",
"formula_anonymous": "A3B4",
"energy_above_hull": 1.5730974142857144,
"spacegroup": 220
},
{
"id": "jvasp-56647",
"created_at": "2022-09-04T14:38:28.581679Z",
"updated_at": "2022-09-04T14:38:28.581703Z",
"structure_string": "Ho4 Mo4 O16 F4\n1.0\n0.000000 5.201656 -0.000247\n12.270368 0.000000 0.000000\n0.000000 -2.620497 -6.117880\nHo Mo O F\n4 4 16 4\ndirect\n0.360984 0.050798 0.199850 Ho\n0.360984 0.449202 0.699850 Ho\n0.639017 0.949202 0.800150 Ho\n0.639017 0.550798 0.300150 Ho\n0.923131 0.855921 0.371158 Mo\n0.923130 0.644080 0.871158 Mo\n0.076870 0.355921 0.128843 Mo\n0.076870 0.144079 0.628843 Mo\n0.240264 0.654321 0.094831 O\n0.759737 0.154320 0.405170 O\n0.308153 0.434564 0.037630 O\n0.691848 0.934564 0.462370 O\n0.003203 0.430741 0.336657 O\n0.691848 0.565436 0.962370 O\n0.240264 0.845680 0.594831 O\n0.810143 0.778318 0.794343 O\n0.996798 0.930741 0.163343 O\n0.759736 0.345680 0.905170 O\n0.308152 0.065436 0.537630 O\n0.189858 0.221682 0.205658 O\n0.810143 0.721682 0.294343 O\n0.189857 0.278318 0.705658 O\n0.003203 0.069259 0.836657 O\n0.996798 0.569259 0.663343 O\n0.453820 0.900406 0.036402 F\n0.546181 0.400406 0.463599 F\n0.453819 0.599595 0.536402 F\n0.546181 0.099595 0.963599 F\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Ho",
"Mo",
"O",
"F"
],
"chemical_system": "F-Ho-Mo-O",
"density": 5.849109217676998,
"density_atomic": 0.07170493202035656,
"volume": 390.48917851356424,
"volume_molar": 8.39850285094804,
"formula_full": "Ho4 Mo4 O16 F4",
"formula_reduced": "HoMoO4F",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.314850821309524,
"spacegroup": 14
},
{
"id": "jvasp-14315",
"created_at": "2022-09-04T14:37:07.015628Z",
"updated_at": "2022-09-04T14:37:07.015643Z",
"structure_string": "Yb8 S8 O4\n1.0\n0.000000 7.632895 0.039835\n6.527318 0.000000 0.000000\n0.000000 -1.439889 -7.844788\nYb S O\n8 8 4\ndirect\n0.774621 0.030861 0.842259 Yb\n0.725378 0.530861 0.157743 Yb\n0.225379 0.969139 0.157742 Yb\n0.274621 0.469139 0.842258 Yb\n0.640663 0.146422 0.414064 Yb\n0.859336 0.646422 0.585938 Yb\n0.359336 0.853578 0.585937 Yb\n0.140663 0.353578 0.414063 Yb\n0.461440 0.560945 0.371444 S\n0.038559 0.060945 0.628557 S\n0.538559 0.439055 0.628557 S\n0.961440 0.939055 0.371444 S\n0.003161 0.337926 0.027747 S\n0.503161 0.162074 0.027747 S\n0.496839 0.837926 0.972254 S\n0.996839 0.662075 0.972254 S\n0.846476 0.413788 0.383978 O\n0.153523 0.586212 0.616023 O\n0.346476 0.086212 0.383977 O\n0.653523 0.913788 0.616024 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Yb",
"S",
"O"
],
"chemical_system": "O-S-Yb",
"density": 7.250084271673254,
"density_atomic": 0.05122016081879791,
"volume": 390.4712457025312,
"volume_molar": 11.757364021765941,
"formula_full": "Yb8 S8 O4",
"formula_reduced": "Yb2S2O",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.5545049799999999,
"spacegroup": 14
}
]
}