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_atomic&page=4523",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4521",
"results": [
{
"id": "jvasp-119696",
"created_at": "2022-09-04T14:38:52.486098Z",
"updated_at": "2022-09-04T14:38:52.486122Z",
"structure_string": "Li2 Fe4 O6\n1.0\n2.882211 -0.000108 0.000212\n0.000166 4.991978 0.040643\n-0.000612 -0.142016 7.288945\nLi Fe O\n2 4 6\ndirect\n0.500003 0.499739 0.490927 Li\n-0.000019 0.000293 0.509076 Li\n0.000007 0.678432 0.177378 Fe\n0.499992 0.821562 0.822620 Fe\n0.500017 0.151123 0.176129 Fe\n-0.000011 0.348877 0.823869 Fe\n0.499999 0.526959 0.008031 O\n0.000001 0.973037 0.991967 O\n0.499984 0.149957 0.682105 O\n-0.000013 0.680660 0.673808 O\n0.500012 0.819341 0.326187 O\n0.000018 0.350039 0.317897 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 5.275920043332111,
"density_atomic": 0.11440611783684174,
"volume": 104.88949565716047,
"volume_molar": 5.263827559106908,
"formula_full": "Li2 Fe4 O6",
"formula_reduced": "LiFe2O3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.484883583333333,
"spacegroup": 11
},
{
"id": "jvasp-31334",
"created_at": "2022-09-04T14:38:03.339121Z",
"updated_at": "2022-09-04T14:38:03.339151Z",
"structure_string": "Mg1 H12 Se1 O9\n1.0\n5.872169 -0.059136 -0.801670\n-0.910597 5.801437 -0.801670\n-0.051096 -0.059136 5.926417\nMg H Se O\n1 12 1 9\ndirect\n-0.000090 -0.000090 -0.000090 Mg\n0.382201 0.189323 0.815585 H\n0.284024 0.085121 0.421290 H\n0.085121 0.421290 0.284025 H\n0.421289 0.284025 0.085121 H\n0.740809 0.136460 0.630260 H\n0.136460 0.630260 0.740810 H\n0.630260 0.740809 0.136461 H\n0.954376 0.027639 0.536271 H\n0.027639 0.536271 0.954377 H\n0.815584 0.382201 0.189323 H\n0.536271 0.954377 0.027640 H\n0.189323 0.815585 0.382201 H\n0.542009 0.542009 0.542010 Se\n0.964212 0.339528 0.146570 O\n0.339528 0.146569 0.964213 O\n0.874932 0.056211 0.671834 O\n0.056211 0.671834 0.874933 O\n0.671834 0.874933 0.056212 O\n0.501593 0.257185 0.587847 O\n0.257185 0.587847 0.501594 O\n0.587846 0.501594 0.257186 O\n0.146569 0.964212 0.339528 O\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Mg",
"H",
"Se",
"O"
],
"chemical_system": "H-Mg-O-Se",
"density": 2.1424756689241473,
"density_atomic": 0.11441954411063636,
"volume": 201.01460968731422,
"volume_molar": 5.263209888493329,
"formula_full": "Mg1 H12 Se1 O9",
"formula_reduced": "MgH12SeO9",
"formula_anonymous": "ABC9D12",
"energy_above_hull": 2.8872510398550726,
"spacegroup": 146
},
{
"id": "jvasp-31192",
"created_at": "2022-09-04T14:38:35.590644Z",
"updated_at": "2022-09-04T14:38:35.590678Z",
"structure_string": "Li2 Ti2 O4\n1.0\n5.750817 -0.000000 -0.000000\n5.750817 5.112227 0.093330\n2.875408 3.452142 2.441187\nLi Ti O\n2 2 4\ndirect\n0.750002 -0.000001 0.500001 Li\n0.500000 0.500000 0.500001 Li\n0.250004 -0.000001 0.500001 Ti\n-0.000003 0.500000 0.500001 Ti\n0.000440 0.999997 0.999128 O\n0.249561 0.500002 0.000873 O\n0.750438 0.499997 0.999128 O\n0.499563 0.000002 0.000873 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Ti",
"O"
],
"chemical_system": "Li-O-Ti",
"density": 4.123361207816709,
"density_atomic": 0.11442173473219636,
"volume": 69.91678651546378,
"volume_molar": 5.26310912353741,
"formula_full": "Li2 Ti2 O4",
"formula_reduced": "LiTiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6131563333333332,
"spacegroup": 141
},
{
"id": "jvasp-114971",
"created_at": "2022-09-04T14:38:43.544349Z",
"updated_at": "2022-09-04T14:38:43.544366Z",
"structure_string": "Ge1 C3\n1.0\n3.963559 0.159085 0.834844\n2.286128 -4.588940 -0.133596\n-1.673002 1.018420 -2.092962\nGe C\n1 3\ndirect\n0.610653 0.386803 0.519742 Ge\n0.110627 0.886823 0.019692 C\n0.610609 0.088921 0.721792 C\n0.110645 0.684688 0.317593 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ge",
"C"
],
"chemical_system": "C-Ge",
"density": 5.1649431829610615,
"density_atomic": 0.11448758191271845,
"volume": 34.93828704539736,
"volume_molar": 5.260082062516686,
"formula_full": "Ge1 C3",
"formula_reduced": "GeC3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.9374264875,
"spacegroup": 115
},
{
"id": "jvasp-54758",
"created_at": "2022-09-04T14:37:27.659506Z",
"updated_at": "2022-09-04T14:37:27.659534Z",
"structure_string": "Te1 H6 O6\n1.0\n5.308369 -0.040243 0.111075\n-2.470238 4.939631 -0.125047\n-2.472600 -1.651010 4.319922\nTe H O\n1 6 6\ndirect\n0.012944 0.981009 0.026288 Te\n0.118747 0.421143 0.869119 H\n0.625539 0.167950 0.309500 H\n0.007944 0.737145 0.603675 H\n0.614669 0.540599 0.067189 H\n0.516813 0.927153 0.570383 H\n0.173538 0.419644 0.396902 H\n0.198970 0.288164 0.873678 O\n0.475605 0.149025 0.383933 O\n0.098263 0.746033 0.820494 O\n0.862741 0.704559 0.209926 O\n0.554037 0.784125 0.662816 O\n0.948736 0.237726 0.234024 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Te",
"H",
"O"
],
"chemical_system": "H-O-Te",
"density": 3.358395310401941,
"density_atomic": 0.11449087937200417,
"volume": 113.54616255291702,
"volume_molar": 5.259930566550056,
"formula_full": "Te1 H6 O6",
"formula_reduced": "Te(HO)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 2.8375875974358973,
"spacegroup": 1
},
{
"id": "jvasp-48217",
"created_at": "2022-09-04T14:38:05.812691Z",
"updated_at": "2022-09-04T14:38:05.812707Z",
"structure_string": "Li3 Fe2 O6\n1.0\n4.889665 -0.004816 0.002812\n-2.431027 4.242491 0.000433\n-0.844005 -1.452056 4.632800\nLi Fe O\n3 2 6\ndirect\n0.999382 0.495198 0.000558 Li\n0.650689 0.844373 0.001068 Li\n0.348545 0.146506 0.001071 Li\n0.832238 0.663256 0.500896 Fe\n0.167428 0.328063 0.500897 Fe\n0.791370 0.287192 0.270817 O\n0.208276 0.704098 0.731013 O\n0.422647 0.548054 0.274288 O\n0.947451 0.072864 0.727505 O\n0.577041 0.443273 0.727501 O\n0.052230 0.918461 0.274278 O\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 3.949575805391718,
"density_atomic": 0.1144959095583671,
"volume": 96.07330115485462,
"volume_molar": 5.259699480294591,
"formula_full": "Li3 Fe2 O6",
"formula_reduced": "Li3(FeO3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 2.414482909090909,
"spacegroup": 12
},
{
"id": "jvasp-115504",
"created_at": "2022-09-04T14:38:47.276365Z",
"updated_at": "2022-09-04T14:38:47.276392Z",
"structure_string": "B1 Sb1 O3\n1.0\n3.521260 0.000000 -0.000000\n0.000000 3.521260 -0.000000\n0.000000 0.000000 3.521260\nB Sb O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 B\n0.000000 0.000000 0.000000 Sb\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"B",
"Sb",
"O"
],
"chemical_system": "B-O-Sb",
"density": 6.867497205399741,
"density_atomic": 0.11451851936575003,
"volume": 43.66106047905637,
"volume_molar": 5.25866103871501,
"formula_full": "B1 Sb1 O3",
"formula_reduced": "BSbO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.629707836666667,
"spacegroup": 221
},
{
"id": "jvasp-47094",
"created_at": "2022-09-04T14:38:08.476010Z",
"updated_at": "2022-09-04T14:38:08.476033Z",
"structure_string": "Li8 Ni1 O4 F2\n1.0\n5.186941 -0.032537 -0.022480\n-1.759166 4.997155 0.051959\n-2.386640 -0.913549 5.066458\nLi Ni O F\n8 1 4 2\ndirect\n0.187155 0.444630 0.291042 Li\n0.071782 0.200607 0.625276 Li\n0.429292 0.862197 0.634518 Li\n0.588075 0.243215 -0.047340 Li\n0.411924 0.756785 0.047341 Li\n0.570708 0.137803 0.365483 Li\n0.928217 0.799394 0.374724 Li\n0.812845 0.555370 0.708959 Li\n0.000000 0.000000 0.000000 Ni\n0.845469 0.097305 0.229761 O\n0.208966 0.806328 0.251004 O\n0.791034 0.193672 0.748997 O\n0.154531 0.902695 0.770240 O\n0.421348 0.509443 0.710534 F\n0.578652 0.490558 0.289467 F\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Li",
"Ni",
"O",
"F"
],
"chemical_system": "F-Li-Ni-O",
"density": 2.7411767293870968,
"density_atomic": 0.11452274738580527,
"volume": 130.97834572085372,
"volume_molar": 5.258466896286166,
"formula_full": "Li8 Ni1 O4 F2",
"formula_reduced": "Li8Ni(O2F)2",
"formula_anonymous": "AB2C4D8",
"energy_above_hull": 1.1765757976666666,
"spacegroup": 2
},
{
"id": "jvasp-112008",
"created_at": "2022-09-04T14:38:42.612424Z",
"updated_at": "2022-09-04T14:38:42.612451Z",
"structure_string": "Sn1 H16 C9 O6\n1.0\n4.792273 -0.004336 -0.418844\n-0.471368 6.277800 -1.412228\n0.235952 0.015007 9.262890\nSn H C O\n1 16 9 6\ndirect\n0.943792 0.921931 0.101635 Sn\n0.166210 0.452911 0.504227 H\n0.977309 0.741686 0.841852 H\n0.296484 0.614905 0.678939 H\n0.731887 0.715129 0.571525 H\n0.427574 0.782682 0.479632 H\n0.435359 0.440993 0.285048 H\n0.775230 0.403512 0.359222 H\n0.297745 0.047432 0.308528 H\n0.141523 0.093844 0.577739 H\n0.598595 0.232702 0.518648 H\n0.669357 0.383134 0.701371 H\n0.509883 0.450902 0.938675 H\n0.216716 0.409360 0.039444 H\n0.043307 0.398457 0.789545 H\n0.987899 0.143969 0.823327 H\n0.418819 0.030733 0.691409 H\n0.343235 0.333385 0.949602 C\n0.151563 0.259936 0.806436 C\n0.499603 0.321124 0.615593 C\n0.301011 0.163683 0.668833 C\n0.542785 0.647832 0.499080 C\n0.357857 0.510856 0.576333 C\n0.749911 0.666858 0.259164 C\n0.470125 0.151441 0.999926 C\n0.626644 0.522938 0.348279 C\n0.609557 0.818620 0.226240 O\n0.829603 0.723625 0.906826 O\n0.135578 0.119645 0.280265 O\n0.327370 0.976278 0.993087 O\n0.729004 0.177975 0.049563 O\n-0.006226 0.646359 0.211837 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sn",
"density": 2.0144760810514253,
"density_atomic": 0.11453898164911443,
"volume": 279.3808670137361,
"volume_molar": 5.257721583773624,
"formula_full": "Sn1 H16 C9 O6",
"formula_reduced": "SnH16(C3O2)3",
"formula_anonymous": "AB6C9D16",
"energy_above_hull": 4.429896021875,
"spacegroup": 1
},
{
"id": "jvasp-34647",
"created_at": "2022-09-04T14:37:14.157048Z",
"updated_at": "2022-09-04T14:37:14.157068Z",
"structure_string": "Mg2 Al4 O8\n1.0\n2.798040 0.000000 0.000000\n-1.399020 4.624381 0.000000\n0.000000 0.000000 9.445809\nMg Al O\n2 4 8\ndirect\n0.611660 0.223319 0.250000 Mg\n0.388340 0.776681 0.750000 Mg\n0.134187 0.268373 0.926726 Al\n0.865813 0.731626 0.426726 Al\n0.865813 0.731626 0.073274 Al\n0.134187 0.268373 0.573274 Al\n0.769972 0.539943 0.889811 O\n0.769972 0.539943 0.610189 O\n0.230028 0.460056 0.389811 O\n0.047518 0.095035 0.750000 O\n0.230028 0.460056 0.110189 O\n0.500000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n0.952482 0.904965 0.250000 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Al",
"O"
],
"chemical_system": "Al-Mg-O",
"density": 3.8657391185821086,
"density_atomic": 0.1145463748237752,
"volume": 122.2212402752895,
"volume_molar": 5.257382234282676,
"formula_full": "Mg2 Al4 O8",
"formula_reduced": "MgAl2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.5299312357142854,
"spacegroup": 63
},
{
"id": "jvasp-25116",
"created_at": "2022-09-04T14:38:00.684951Z",
"updated_at": "2022-09-04T14:38:00.684976Z",
"structure_string": "C4\n1.0\n2.059067 2.059067 2.059067\n2.059067 -2.059067 -2.059067\n-2.059067 2.059067 -2.059067\nC\n4\ndirect\n0.250000 0.750001 0.250000 C\n0.000000 0.750001 0.500001 C\n0.500001 0.500001 0.250000 C\n0.250000 0.000000 0.000000 C\n",
"nsites": 4,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 2.284577955209446,
"density_atomic": 0.11454827802058788,
"volume": 34.919774169639425,
"volume_molar": 5.257294883924518,
"formula_full": "C4",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 1.29657,
"spacegroup": 214
},
{
"id": "jvasp-103909",
"created_at": "2022-09-04T14:36:59.404452Z",
"updated_at": "2022-09-04T14:36:59.404462Z",
"structure_string": "Zn1 H6 C5 O4\n1.0\n3.843174 0.252421 0.097928\n1.229012 4.364785 0.373578\n-0.705440 0.145444 8.480967\nZn H C O\n1 6 5 4\ndirect\n0.833778 0.840366 0.757269 Zn\n-0.099136 0.486251 0.375732 H\n0.357707 0.464774 0.431433 H\n0.154544 0.019022 0.216905 H\n0.006786 0.582719 0.093543 H\n0.608438 0.004910 0.273419 H\n0.465973 0.548147 0.138935 H\n0.214819 0.100660 0.541174 C\n0.186877 0.324030 0.396777 C\n0.321350 0.163609 0.248865 C\n0.287268 0.409884 0.111326 C\n0.394151 0.291805 0.953713 C\n-0.044982 0.174673 0.631933 O\n0.500497 0.850966 0.568060 O\n0.617525 0.010525 0.952799 O\n0.279147 0.476179 0.827048 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Zn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zn",
"density": 2.3242663654717752,
"density_atomic": 0.11454940226052814,
"volume": 139.67772580436537,
"volume_molar": 5.257243286441078,
"formula_full": "Zn1 H6 C5 O4",
"formula_reduced": "ZnH6C5O4",
"formula_anonymous": "AB4C5D6",
"energy_above_hull": 4.145718399999999,
"spacegroup": 1
}
]
}