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=-density&page=4534",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=4532",
"results": [
{
"id": "jvasp-14813",
"created_at": "2022-09-04T14:35:54.566533Z",
"updated_at": "2022-09-04T14:35:54.566556Z",
"structure_string": "Rb1\n1.0\n4.528428 0.000000 -1.601041\n-2.264214 3.921735 -1.601041\n-0.000000 -0.000000 4.803124\nRb\n1\ndirect\n0.000000 0.000000 0.000000 Rb\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.663803802865864,
"density_atomic": 0.011723316502055867,
"volume": 85.30009403265998,
"volume_molar": 51.36891731059145,
"formula_full": "Rb1",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.0310099999999999,
"spacegroup": 229
},
{
"id": "jvasp-21207",
"created_at": "2022-09-04T14:35:44.454259Z",
"updated_at": "2022-09-04T14:35:44.454279Z",
"structure_string": "Rb1\n1.0\n4.528429 0.000000 -1.601041\n-2.264215 3.921736 -1.601041\n-0.000000 -0.000000 4.803125\nRb\n1\ndirect\n0.000000 0.000000 0.000000 Rb\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.6638026648009627,
"density_atomic": 0.011723308483144615,
"volume": 85.30015237914851,
"volume_molar": 51.36895244766812,
"formula_full": "Rb1",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.0310099999999999,
"spacegroup": 229
},
{
"id": "jvasp-103777",
"created_at": "2022-09-04T14:36:59.788946Z",
"updated_at": "2022-09-04T14:36:59.788968Z",
"structure_string": "H4 C7 S1 O2\n1.0\n3.773501 0.015327 0.007613\n0.232312 5.338031 0.004837\n-0.011175 -0.004349 7.541055\nH C S O\n4 7 1 2\ndirect\n0.728083 0.855339 0.405520 H\n0.194408 0.163971 0.741742 H\n0.193928 0.163792 0.405046 H\n0.728545 0.855514 0.739950 H\n0.299804 0.316477 0.481130 C\n0.300054 0.316577 0.665374 C\n0.459425 0.509348 0.391770 C\n0.459896 0.509546 0.754356 C\n0.599614 0.710803 0.480117 C\n0.599870 0.710898 0.665650 C\n0.412613 0.598969 0.073053 C\n0.185929 0.867584 0.073059 S\n0.528527 0.459529 0.212263 O\n0.529513 0.459922 0.933833 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.6637844326349112,
"density_atomic": 0.09218189700892933,
"volume": 151.8736373872179,
"volume_molar": 6.532888729135892,
"formula_full": "H4 C7 S1 O2",
"formula_reduced": "H4C7SO2",
"formula_anonymous": "AB2C4D7",
"energy_above_hull": 5.220439071428571,
"spacegroup": 6
},
{
"id": "jvasp-25296",
"created_at": "2022-09-04T14:37:28.230991Z",
"updated_at": "2022-09-04T14:37:28.231014Z",
"structure_string": "Rb1\n1.0\n5.417859 -0.000000 1.176917\n2.708930 3.922585 0.588459\n1.876250 -0.000000 4.421645\nRb\n1\ndirect\n0.000000 0.000000 0.000000 Rb\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.663668339431285,
"density_atomic": 0.011722362014083615,
"volume": 85.30703955385174,
"volume_molar": 51.37310000121828,
"formula_full": "Rb1",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy_above_hull": 0.03106,
"spacegroup": 229
},
{
"id": "jvasp-113626",
"created_at": "2022-09-04T14:38:48.380346Z",
"updated_at": "2022-09-04T14:38:48.380371Z",
"structure_string": "Sr1 Ga1 N1\n1.0\n4.890242 0.000000 0.000000\n0.000000 4.890242 0.000000\n0.000000 0.000000 7.151925\nSr Ga N\n1 1 1\ndirect\n0.000000 0.000000 0.707878 Sr\n0.000000 0.000000 0.256089 Ga\n0.000000 0.000000 0.011576 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"Ga",
"N"
],
"chemical_system": "Ga-N-Sr",
"density": 1.6635995407286714,
"density_atomic": 0.017540323571039053,
"volume": 171.03447310135832,
"volume_molar": 34.33312239429379,
"formula_full": "Sr1 Ga1 N1",
"formula_reduced": "SrGaN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4403739616666669,
"spacegroup": 99
},
{
"id": "jvasp-118486",
"created_at": "2022-09-04T14:38:51.629530Z",
"updated_at": "2022-09-04T14:38:51.629566Z",
"structure_string": "Sc1 H1 O1\n1.0\n3.185689 -0.000000 -0.000000\n0.000000 3.185689 0.000000\n-0.000000 0.000000 6.094926\nSc H O\n1 1 1\ndirect\n0.000000 0.000000 0.726509 Sc\n0.000000 0.000000 0.183907 H\n0.000000 0.000000 0.025350 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sc",
"H",
"O"
],
"chemical_system": "H-O-Sc",
"density": 1.6634437175241896,
"density_atomic": 0.04850048323834027,
"volume": 61.85505379930855,
"volume_molar": 12.416661356560295,
"formula_full": "Sc1 H1 O1",
"formula_reduced": "ScHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.96538625,
"spacegroup": 99
},
{
"id": "jvasp-113553",
"created_at": "2022-09-04T14:38:48.336720Z",
"updated_at": "2022-09-04T14:38:48.336753Z",
"structure_string": "Li1 Ca1 N1\n1.0\n4.011054 -0.000000 -0.000000\n-2.005527 3.473674 0.000000\n-0.000000 -0.000000 4.372570\nLi Ca N\n1 1 1\ndirect\n0.333332 0.666666 0.000000 Li\n0.000000 0.000000 0.000000 Ca\n0.666665 0.333333 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Ca",
"N"
],
"chemical_system": "Ca-Li-N",
"density": 1.663326587412752,
"density_atomic": 0.049242139833111084,
"volume": 60.92342879833096,
"volume_molar": 12.229648793512892,
"formula_full": "Li1 Ca1 N1",
"formula_reduced": "LiCaN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5920645566666662,
"spacegroup": 187
},
{
"id": "jvasp-55732",
"created_at": "2022-09-04T14:38:36.277967Z",
"updated_at": "2022-09-04T14:38:36.277987Z",
"structure_string": "K4 Li2 Al2 H12\n1.0\n5.504749 -0.000000 0.000000\n0.000000 5.504748 0.000000\n0.000000 0.000000 7.786821\nK Li Al H\n4 2 2 12\ndirect\n0.000000 0.500000 0.249986 K\n0.000000 0.500000 0.750014 K\n0.500000 0.000000 0.749986 K\n0.500000 0.000000 0.250014 K\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.270114 0.270153 0.500000 H\n0.729887 0.270153 0.500000 H\n0.729887 0.729848 0.500000 H\n0.270114 0.729848 0.500000 H\n0.000000 0.000000 0.770228 H\n0.229887 0.229848 0.000000 H\n0.770114 0.770153 0.000000 H\n0.229887 0.770153 0.000000 H\n0.500000 0.500000 0.729771 H\n0.770114 0.229848 0.000000 H\n0.000000 0.000000 0.229771 H\n0.500000 0.500000 0.270229 H\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"Li",
"Al",
"H"
],
"chemical_system": "Al-H-K-Li",
"density": 1.6631803078898857,
"density_atomic": 0.08476075971181897,
"volume": 235.95824374390568,
"volume_molar": 7.104868786540948,
"formula_full": "K4 Li2 Al2 H12",
"formula_reduced": "K2LiAlH6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.87356088,
"spacegroup": 225
},
{
"id": "jvasp-104115",
"created_at": "2022-09-04T14:36:50.417310Z",
"updated_at": "2022-09-04T14:36:50.417335Z",
"structure_string": "H8 C15 S3\n1.0\n3.888695 0.008774 0.648028\n1.930749 6.108819 0.308471\n0.100997 0.024903 11.983899\nH C S\n8 15 3\ndirect\n0.654440 0.152985 0.548249 H\n0.127851 0.856438 0.229818 H\n0.534981 0.765094 0.874971 H\n0.566872 0.765293 0.041943 H\n0.882537 0.856223 0.687064 H\n0.699376 0.860570 0.367711 H\n0.306606 0.860530 0.549154 H\n0.060234 0.153038 0.368587 H\n0.892604 0.309128 0.407324 C\n0.665679 0.309102 0.509514 C\n0.913387 0.506666 0.353269 C\n0.447064 0.506614 0.563579 C\n0.694091 0.704484 0.407411 C\n0.468217 0.704459 0.509446 C\n0.778691 0.310117 0.958441 C\n0.553506 0.425394 0.057785 C\n0.146578 0.511127 0.246092 C\n0.209470 0.511037 0.670765 C\n0.762261 0.644032 0.827192 C\n0.229162 0.692503 0.193804 C\n0.945382 0.692346 0.723075 C\n0.460763 0.644173 0.089704 C\n0.888514 0.425336 0.859098 C\n0.363462 0.277270 0.163887 S\n0.916230 0.035208 0.958433 S\n0.226718 0.277241 0.752964 S\n",
"nsites": 26,
"nelements": 3,
"elements": [
"H",
"C",
"S"
],
"chemical_system": "C-H-S",
"density": 1.6625192615161302,
"density_atomic": 0.09152343268940087,
"volume": 284.0802539414696,
"volume_molar": 6.579889524507981,
"formula_full": "H8 C15 S3",
"formula_reduced": "H8(C5S)3",
"formula_anonymous": "A3B8C15",
"energy_above_hull": 5.750107307692306,
"spacegroup": 5
},
{
"id": "jvasp-90218",
"created_at": "2022-09-04T14:36:09.520776Z",
"updated_at": "2022-09-04T14:36:09.520889Z",
"structure_string": "Mg1 N8\n1.0\n-3.040497 -3.040497 3.683255\n-3.040497 3.040497 -3.683255\n3.040497 -3.040497 -3.683255\nMg N\n1 8\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 N\n0.500000 -0.000000 0.500000 N\n0.764138 0.096019 0.668119 N\n0.235863 0.903982 0.331882 N\n0.572100 0.668119 0.903982 N\n0.427901 0.331882 0.096019 N\n0.000000 0.690518 0.690518 N\n0.000000 0.309483 0.309483 N\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Mg",
"N"
],
"chemical_system": "Mg-N",
"density": 1.6624580461448866,
"density_atomic": 0.06607871251571208,
"volume": 136.20120092170373,
"volume_molar": 9.113586707017129,
"formula_full": "Mg1 N8",
"formula_reduced": "MgN8",
"formula_anonymous": "AB8",
"energy_above_hull": 5.44167056111111,
"spacegroup": 87
},
{
"id": "jvasp-112092",
"created_at": "2022-09-04T14:38:41.459658Z",
"updated_at": "2022-09-04T14:38:41.459686Z",
"structure_string": "H8 C10 S2 O4\n1.0\n5.568839 -0.126971 -0.590730\n-2.333265 5.970777 -2.133712\n-0.103980 -0.020082 7.792791\nH C S O\n8 10 2 4\ndirect\n0.885622 0.992136 0.888123 H\n0.885837 0.992034 0.388142 H\n0.334009 0.053402 0.395198 H\n0.333859 0.053376 0.895213 H\n0.794951 0.381953 0.593759 H\n0.794847 0.381855 0.093776 H\n0.617578 0.969851 0.715672 H\n0.617664 0.969731 0.215793 H\n0.823344 0.993480 0.249749 C\n0.823242 0.993570 0.749703 C\n0.222404 0.311578 0.844341 C\n0.222426 0.311555 0.344351 C\n0.650656 0.615095 0.028477 C\n0.635773 0.407469 0.022273 C\n0.635836 0.407530 0.522267 C\n0.388204 0.230755 0.915302 C\n0.388291 0.230777 0.415295 C\n0.650637 0.615145 0.528495 C\n0.357842 0.602607 0.404375 S\n0.357909 0.602622 0.904351 S\n0.968931 0.201820 0.239433 O\n0.864779 0.815124 0.610331 O\n0.864828 0.815055 0.110309 O\n0.968919 0.201890 0.739397 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.6615465209058262,
"density_atomic": 0.09369776444688133,
"volume": 256.14271740288916,
"volume_molar": 6.42719791187125,
"formula_full": "H8 C10 S2 O4",
"formula_reduced": "H4C5SO2",
"formula_anonymous": "AB2C4D5",
"energy_above_hull": 4.7839055833333335,
"spacegroup": 1
},
{
"id": "jvasp-118460",
"created_at": "2022-09-04T14:38:52.269577Z",
"updated_at": "2022-09-04T14:38:52.269603Z",
"structure_string": "Li1 H2 N1\n1.0\n2.621047 0.000000 0.000000\n0.000000 2.621047 0.000000\n0.000000 -0.000000 3.341543\nLi H N\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 H\n0.000000 0.500000 0.500000 H\n0.500000 0.500000 0.500000 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"H",
"N"
],
"chemical_system": "H-Li-N",
"density": 1.6610856295556489,
"density_atomic": 0.17424620166462296,
"volume": 22.95602407275955,
"volume_molar": 3.4561102064026628,
"formula_full": "Li1 H2 N1",
"formula_reduced": "LiH2N",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.7398183125,
"spacegroup": 123
}
]
}