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=62",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=60",
"results": [
{
"id": "jvasp-96953",
"created_at": "2022-09-04T14:36:32.461994Z",
"updated_at": "2022-09-04T14:36:32.462008Z",
"structure_string": "H32 C12 N8 O4\n1.0\n5.926411 0.000000 0.000000\n0.000000 7.832951 -2.520270\n0.000000 0.205656 9.052728\nH C N O\n32 12 8 4\ndirect\n0.721559 0.745372 0.939109 H\n0.472780 0.667514 0.459362 H\n0.903899 0.875239 0.862540 H\n0.838127 0.610244 0.644421 H\n0.278441 0.254628 0.060891 H\n0.756767 0.150071 0.768793 H\n0.338127 0.889757 0.855579 H\n0.527220 0.332487 0.540638 H\n0.712828 0.943405 0.231354 H\n0.161872 0.389757 0.355579 H\n0.455677 0.397545 0.882235 H\n0.287172 0.056596 0.768647 H\n0.221559 0.754629 0.560891 H\n0.459790 0.946388 0.124314 H\n0.256767 0.349930 0.731208 H\n0.778441 0.245372 0.439109 H\n0.243233 0.849929 0.231208 H\n0.027220 0.167514 0.959363 H\n0.040210 0.446388 0.624314 H\n0.955677 0.102455 0.617765 H\n-0.027220 0.832486 0.040638 H\n0.044323 0.897545 0.382235 H\n0.743233 0.650071 0.268792 H\n0.661872 0.110243 0.144421 H\n0.540210 0.053613 0.875687 H\n0.596101 0.375239 0.362540 H\n0.096101 0.124761 0.137460 H\n0.959790 0.553612 0.375686 H\n0.787172 0.443405 0.731354 H\n0.544322 0.602455 0.117765 H\n0.403899 0.624761 0.637460 H\n0.212828 0.556595 0.268646 H\n0.212157 0.579418 0.907374 C\n0.581998 0.025677 0.203879 C\n0.399150 0.720765 0.573684 C\n0.287842 0.079418 0.407374 C\n0.100850 0.220765 0.073684 C\n0.899150 0.779235 0.926316 C\n0.918002 0.525677 0.703879 C\n0.418002 0.974324 0.796122 C\n0.712157 0.920582 0.592627 C\n0.081998 0.474323 0.296122 C\n0.600850 0.279235 0.426316 C\n0.787842 0.420582 0.092626 C\n0.975241 0.371106 0.156067 N\n0.685298 0.567881 0.168881 N\n0.185298 0.932119 0.331119 N\n0.475241 0.128894 0.343933 N\n0.314701 0.432119 0.831119 N\n0.524759 0.871106 0.656067 N\n0.024759 0.628894 0.843934 N\n0.814701 0.067882 0.668882 N\n0.293974 0.671318 0.033323 O\n0.206026 0.171319 0.533323 O\n0.706026 0.328682 0.966677 O\n0.793974 0.828682 0.466677 O\n",
"nsites": 56,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.3825057741431968,
"density_atomic": 0.13229044541704835,
"volume": 423.31099440673023,
"volume_molar": 4.552211417094468,
"formula_full": "H32 C12 N8 O4",
"formula_reduced": "H8C3N2O",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 4.515632857142857,
"spacegroup": 14
},
{
"id": "jvasp-79788",
"created_at": "2022-09-04T14:36:47.144422Z",
"updated_at": "2022-09-04T14:36:47.144448Z",
"structure_string": "Na1 N3\n1.0\n3.572693 -1.200377 1.877656\n0.499262 3.735745 1.877656\n0.607925 0.378521 6.159169\nNa N\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.932988 0.932986 0.623088 N\n0.500000 0.499999 0.500001 N\n0.067012 0.067011 0.376914 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"N"
],
"chemical_system": "N-Na",
"density": 1.3826319960630358,
"density_atomic": 0.051231633563738777,
"volume": 78.07676081660529,
"volume_molar": 11.75473109306124,
"formula_full": "Na1 N3",
"formula_reduced": "NaN3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.8768521875,
"spacegroup": 12
},
{
"id": "jvasp-30519",
"created_at": "2022-09-04T14:36:51.438558Z",
"updated_at": "2022-09-04T14:36:51.438584Z",
"structure_string": "Al4 P4\n1.0\n7.762985 -0.000017 0.000003\n-0.000085 7.759811 -0.000003\n0.000002 -0.000002 4.621245\nAl P\n4 4\ndirect\n0.359780 0.640920 0.499999 Al\n0.142212 0.140929 0.499999 Al\n0.859782 0.859080 0.499999 Al\n0.642213 0.359071 0.499999 Al\n0.154758 0.845823 0.500003 P\n0.847248 0.154187 0.500001 P\n0.654757 0.654175 0.500000 P\n0.347249 0.345814 0.500003 P\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Al",
"P"
],
"chemical_system": "Al-P",
"density": 1.3828127246389739,
"density_atomic": 0.028737640178413033,
"volume": 278.38054726599967,
"volume_molar": 20.95558550602104,
"formula_full": "Al4 P4",
"formula_reduced": "AlP",
"formula_anonymous": "AB",
"energy_above_hull": 1.55473415,
"spacegroup": 127
},
{
"id": "jvasp-118748",
"created_at": "2022-09-04T14:38:53.633549Z",
"updated_at": "2022-09-04T14:38:53.633577Z",
"structure_string": "N2 Cl1\n1.0\n4.195051 0.000000 0.000000\n0.000000 6.897198 0.000000\n0.000000 0.000000 2.632190\nN Cl\n2 1\ndirect\n0.131981 0.939999 0.000000 N\n0.868019 0.939999 0.000000 N\n0.000000 0.440002 0.000000 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"N",
"Cl"
],
"chemical_system": "Cl-N",
"density": 1.3837759827417477,
"density_atomic": 0.03939073470966343,
"volume": 76.1600417487017,
"volume_molar": 15.288216389938608,
"formula_full": "N2 Cl1",
"formula_reduced": "N2Cl",
"formula_anonymous": "AB2",
"energy_above_hull": 3.1724135224999994,
"spacegroup": 47
},
{
"id": "jvasp-121257",
"created_at": "2022-09-04T14:38:55.239206Z",
"updated_at": "2022-09-04T14:38:55.239233Z",
"structure_string": "Na3 P1\n1.0\n4.764663 1.307444 -0.952953\n1.459316 -5.264035 -0.351866\n1.501745 0.720601 -4.738854\nNa P\n3 1\ndirect\n0.051885 -0.063239 0.112284 Na\n0.386074 0.370540 0.445274 Na\n0.720377 0.804296 0.778280 Na\n0.386173 0.870547 0.445265 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"P"
],
"chemical_system": "Na-P",
"density": 1.3843758942516238,
"density_atomic": 0.033366621682371214,
"volume": 119.88028150039966,
"volume_molar": 18.04839823859577,
"formula_full": "Na3 P1",
"formula_reduced": "Na3P",
"formula_anonymous": "AB3",
"energy_above_hull": null,
"spacegroup": 164
},
{
"id": "jvasp-101891",
"created_at": "2022-09-04T14:36:39.340718Z",
"updated_at": "2022-09-04T14:36:39.340731Z",
"structure_string": "Ti1 H22 C12 O4\n1.0\n4.773832 0.146807 0.485565\n1.781593 7.101250 2.843916\n-0.108657 -0.275290 9.796747\nTi H C O\n1 22 12 4\ndirect\n0.292340 0.331282 0.132733 Ti\n0.501047 0.668903 0.622107 H\n0.392133 0.964612 0.152150 H\n0.398052 0.000207 0.324515 H\n0.571184 0.617593 -0.004672 H\n0.218144 0.696188 0.069893 H\n0.304957 0.510329 0.720856 H\n0.719111 0.986153 0.214364 H\n0.357977 0.366966 0.528148 H\n0.701691 0.370732 0.576974 H\n0.662167 0.668377 0.356435 H\n0.247276 0.638910 0.905820 H\n0.264038 0.889807 0.719952 H\n0.339795 0.633250 0.306960 H\n0.850721 0.935464 0.890968 H\n0.654010 0.134852 0.755394 H\n0.244833 0.090196 0.884459 H\n0.064068 0.288014 0.743494 H\n0.105336 0.838025 0.438461 H\n0.834856 0.747205 0.741262 H\n0.679362 0.937556 0.586841 H\n0.068123 0.086230 0.580209 H\n0.925743 0.662357 0.514943 H\n0.027124 0.172213 0.838295 C\n0.042854 0.971353 0.678951 C\n0.875547 0.051975 0.794161 C\n0.061974 0.738036 0.541955 C\n0.888772 0.847645 0.640003 C\n0.548200 0.562903 0.365468 C\n0.859061 0.260167 0.947148 C\n0.346752 0.595125 0.610173 C\n0.725903 0.423161 0.295953 C\n0.480474 0.033322 0.212446 C\n0.349664 0.602208 0.011383 C\n0.492309 0.460751 0.525188 C\n-0.000934 0.410163 0.275482 O\n0.000111 0.325443 0.016661 O\n0.595818 0.268051 0.968012 O\n0.607681 0.315883 0.264818 O\n",
"nsites": 39,
"nelements": 4,
"elements": [
"Ti",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Ti",
"density": 1.385540563529384,
"density_atomic": 0.11698443611448284,
"volume": 333.3776807868183,
"volume_molar": 5.14781364087325,
"formula_full": "Ti1 H22 C12 O4",
"formula_reduced": "TiH22(C3O)4",
"formula_anonymous": "AB4C12D22",
"energy_above_hull": 4.727200572649574,
"spacegroup": 1
},
{
"id": "jvasp-114881",
"created_at": "2022-09-04T14:38:43.087274Z",
"updated_at": "2022-09-04T14:38:43.087289Z",
"structure_string": "Li1 Al1 B1\n1.0\n3.659190 1.580834 0.000000\n1.870136 5.708250 0.000000\n0.000000 0.000000 2.989510\nLi Al B\n1 1 1\ndirect\n-0.077565 0.424029 0.000000 Li\n-0.077477 -0.076043 0.000000 Al\n0.422431 -0.075959 0.000000 B\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Al",
"B"
],
"chemical_system": "Al-B-Li",
"density": 1.3857122785574751,
"density_atomic": 0.055964415011988,
"volume": 53.605491978382645,
"volume_molar": 10.760660606762373,
"formula_full": "Li1 Al1 B1",
"formula_reduced": "LiAlB",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2000184611111115,
"spacegroup": 47
},
{
"id": "jvasp-79557",
"created_at": "2022-09-04T14:37:56.781247Z",
"updated_at": "2022-09-04T14:37:56.781272Z",
"structure_string": "Na1 N3\n1.0\n2.344451 2.900769 -1.945962\n2.344451 -2.900769 -1.945962\n0.538770 0.000000 -6.174097\nNa N\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 N\n0.933005 0.933005 0.623148 N\n0.066994 0.066994 0.376852 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"N"
],
"chemical_system": "N-Na",
"density": 1.3858757989023966,
"density_atomic": 0.05135182846657072,
"volume": 77.89401311394278,
"volume_molar": 11.727217783336235,
"formula_full": "Na1 N3",
"formula_reduced": "NaN3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.876999687500001,
"spacegroup": 12
},
{
"id": "jvasp-120826",
"created_at": "2022-09-04T14:38:54.140896Z",
"updated_at": "2022-09-04T14:38:54.140929Z",
"structure_string": "Mg1 B1 H1\n1.0\n2.677678 0.000000 -0.000000\n-0.000000 2.677678 -0.000000\n-0.000000 -0.000000 6.036525\nMg B H\n1 1 1\ndirect\n0.000000 0.000000 0.634902 Mg\n0.000000 0.000000 0.257661 B\n0.000000 0.000000 0.058353 H\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Mg",
"B",
"H"
],
"chemical_system": "B-H-Mg",
"density": 1.3859274778902215,
"density_atomic": 0.06931345549149114,
"volume": 43.28163959980725,
"volume_molar": 8.68827086645431,
"formula_full": "Mg1 B1 H1",
"formula_reduced": "MgBH",
"formula_anonymous": "ABC",
"energy_above_hull": 2.150410544444445,
"spacegroup": 99
},
{
"id": "jvasp-70523",
"created_at": "2022-09-04T14:35:51.590546Z",
"updated_at": "2022-09-04T14:35:51.590575Z",
"structure_string": "Na1 Li1 Be2\n1.0\n-1.788818 1.788818 4.482842\n1.788818 -1.788818 4.482842\n1.788818 1.788818 -4.482842\nNa Li Be\n1 1 2\ndirect\n0.750001 0.250000 0.500001 Na\n0.250000 0.750001 0.500001 Li\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Li",
"Be"
],
"chemical_system": "Be-Li-Na",
"density": 1.387837006231948,
"density_atomic": 0.06971307749312171,
"volume": 57.378043601570496,
"volume_molar": 8.638466377551872,
"formula_full": "Na1 Li1 Be2",
"formula_reduced": "NaLiBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0674253,
"spacegroup": 139
},
{
"id": "jvasp-116301",
"created_at": "2022-09-04T14:38:42.412754Z",
"updated_at": "2022-09-04T14:38:42.412782Z",
"structure_string": "Li2 Se1\n1.0\n4.054516 0.000000 0.000000\n0.000000 4.754957 0.000000\n0.000000 0.000000 5.759319\nLi Se\n2 1\ndirect\n-0.033328 0.000000 0.786283 Li\n-0.033328 0.000000 0.213718 Li\n0.466657 0.000000 0.000000 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Se"
],
"chemical_system": "Li-Se",
"density": 1.3884710797806403,
"density_atomic": 0.027018703668117185,
"volume": 111.03419456574753,
"volume_molar": 22.288784961605295,
"formula_full": "Li2 Se1",
"formula_reduced": "Li2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5805511222222223,
"spacegroup": 47
},
{
"id": "jvasp-101783",
"created_at": "2022-09-04T14:36:52.082067Z",
"updated_at": "2022-09-04T14:36:52.082097Z",
"structure_string": "H8 C4 O2\n1.0\n4.069620 0.032888 0.302795\n1.397981 4.168892 0.606901\n0.130880 -0.055380 6.224555\nH C O\n8 4 2\ndirect\n0.050512 0.704817 0.879576 H\n0.372522 0.768629 0.027884 H\n0.665023 0.702807 0.660280 H\n0.285767 0.769319 0.514280 H\n0.949488 0.295182 0.120424 H\n0.627478 0.231371 0.972116 H\n0.334976 0.297193 0.339720 H\n0.714232 0.230681 0.485720 H\n0.858324 0.110170 0.067866 C\n0.560934 0.110303 0.413804 C\n0.141675 0.889830 0.932134 C\n0.439065 0.889697 0.586196 C\n0.772510 0.915534 0.253587 O\n0.227490 0.084466 0.746412 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"H",
"C",
"O"
],
"chemical_system": "C-H-O",
"density": 1.3897898633565036,
"density_atomic": 0.13299243292086652,
"volume": 105.26914721779933,
"volume_molar": 4.528183015933927,
"formula_full": "H8 C4 O2",
"formula_reduced": "H4C2O",
"formula_anonymous": "AB2C4",
"energy_above_hull": 3.9942905,
"spacegroup": 2
}
]
}