GET /third-parties/MatprojStructure/?format=api&ordering=nelements
HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept

{
    "count": 146323,
    "next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=nelements&page=2",
    "previous": null,
    "results": [
        {
            "id": "mp-1200830",
            "created_at": "2022-09-04T14:44:28.682155Z",
            "structure_string": "Si41\n1.0\n-6.245230 6.245230 6.245230\n6.245230 -6.245230 6.245230\n6.245230 6.245230 -6.245230\nSi\n41\ndirect\n0.786567 0.391799 0.132608 Si\n0.394768 0.740808 0.608201 Si\n0.653960 0.867392 0.259192 Si\n0.653960 0.259192 0.867392 Si\n0.786567 0.132608 0.391799 Si\n0.394768 0.608201 0.740808 Si\n0.259192 0.653960 0.867392 Si\n0.132608 0.786567 0.391799 Si\n0.608201 0.394768 0.740808 Si\n0.391799 0.786567 0.132608 Si\n0.740808 0.394768 0.608201 Si\n0.867392 0.653960 0.259192 Si\n0.740808 0.608201 0.394768 Si\n0.867392 0.259192 0.653960 Si\n0.391799 0.132608 0.786567 Si\n0.608201 0.740808 0.394768 Si\n0.259192 0.867392 0.653960 Si\n0.132608 0.391799 0.786567 Si\n0.213433 0.346040 0.605232 Si\n0.605232 0.213433 0.346040 Si\n0.346040 0.605232 0.213433 Si\n0.346040 0.213433 0.605232 Si\n0.213433 0.605232 0.346040 Si\n0.605232 0.346040 0.213433 Si\n0.000000 0.000000 0.217376 Si\n0.000000 0.217376 0.000000 Si\n0.782624 0.782624 0.782624 Si\n0.217376 0.000000 0.000000 Si\n0.000000 0.000000 0.000000 Si\n0.000000 0.359283 0.223216 Si\n0.640717 0.863933 0.640717 Si\n0.776784 0.776784 0.136067 Si\n0.776784 0.136067 0.776784 Si\n0.000000 0.223216 0.359283 Si\n0.640717 0.640717 0.863933 Si\n0.136067 0.776784 0.776784 Si\n0.223216 0.000000 0.359283 Si\n0.359283 0.000000 0.223216 Si\n0.863933 0.640717 0.640717 Si\n0.359283 0.223216 0.000000 Si\n0.223216 0.359283 0.000000 Si\n",
            "nsites": 41,
            "nelements": 1,
            "elements": [
                "Si"
            ],
            "chemical_system": "Si",
            "density": 1.9625006580513351,
            "density_atomic": 0.04208027348084233,
            "volume": 974.3282685333749,
            "volume_molar": 14.311077998914786,
            "formula_full": "Si41",
            "formula_reduced": "Si",
            "formula_anonymous": "A",
            "energy": -217.94220064,
            "energy_per_atom": -5.3156634302439025,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -217.94220064,
            "band_gap": 1.1141000000000003,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0033333,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:43.162000Z",
            "spacegroup": 217
        },
        {
            "id": "mp-147",
            "created_at": "2022-09-04T14:44:29.920657Z",
            "structure_string": "Se6\n1.0\n3.708899 -5.644201 0.000000\n3.708899 5.644201 0.000000\n-4.880442 0.000000 4.668428\nSe\n6\ndirect\n0.104852 0.730860 0.862444 Se\n0.730860 0.862444 0.104852 Se\n0.137556 0.895148 0.269140 Se\n0.895148 0.269140 0.137556 Se\n0.862444 0.104852 0.730860 Se\n0.269140 0.137556 0.895148 Se\n",
            "nsites": 6,
            "nelements": 1,
            "elements": [
                "Se"
            ],
            "chemical_system": "Se",
            "density": 4.024939423024076,
            "density_atomic": 0.030697507300279342,
            "volume": 195.45560951606652,
            "volume_molar": 19.617686547289132,
            "formula_full": "Se6",
            "formula_reduced": "Se",
            "formula_anonymous": "A",
            "energy": -20.80068225,
            "energy_per_atom": -3.4667803750000004,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -20.80068225,
            "band_gap": 1.577,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0005135,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:39.493000Z",
            "spacegroup": 148
        },
        {
            "id": "mp-10753",
            "created_at": "2022-09-04T14:44:26.199202Z",
            "structure_string": "Er1\n1.0\n-1.981163 1.981163 1.981163\n1.981163 -1.981163 1.981163\n1.981163 1.981163 -1.981163\nEr\n1\ndirect\n0.000000 0.000000 0.000000 Er\n",
            "nsites": 1,
            "nelements": 1,
            "elements": [
                "Er"
            ],
            "chemical_system": "Er",
            "density": 8.929311557089699,
            "density_atomic": 0.03214988198259702,
            "volume": 31.104313245731593,
            "volume_molar": 18.73145526089281,
            "formula_full": "Er1",
            "formula_reduced": "Er",
            "formula_anonymous": "A",
            "energy": -4.42483749,
            "energy_per_atom": -4.42483749,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -4.42483749,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0125177,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:37.783000Z",
            "spacegroup": 229
        },
        {
            "id": "mp-1189505",
            "created_at": "2022-09-04T14:44:27.822195Z",
            "structure_string": "N16\n1.0\n0.000000 0.000000 -4.239789\n0.000000 -9.460163 0.000000\n-9.709648 0.000000 0.000000\nN\n16\ndirect\n0.000000 0.500000 0.500000 N\n0.000000 0.000000 0.000000 N\n0.000000 0.500000 0.000000 N\n0.000000 0.000000 0.500000 N\n0.000000 0.500000 0.377713 N\n0.000000 0.000000 0.122287 N\n0.000000 0.500000 0.622287 N\n0.000000 0.000000 0.877713 N\n0.888135 0.614897 0.000000 N\n0.111865 0.385103 0.000000 N\n0.888135 0.885103 0.500000 N\n0.111865 0.114897 0.500000 N\n0.466871 0.750000 0.250000 N\n0.533129 0.250000 0.250000 N\n0.533129 0.250000 0.750000 N\n0.466871 0.750000 0.750000 N\n",
            "nsites": 16,
            "nelements": 1,
            "elements": [
                "N"
            ],
            "chemical_system": "N",
            "density": 0.955561311721699,
            "density_atomic": 0.04108408637285692,
            "volume": 389.4451942971949,
            "volume_molar": 14.658086114770356,
            "formula_full": "N16",
            "formula_reduced": "N",
            "formula_anonymous": "A",
            "energy": -98.54534138,
            "energy_per_atom": -6.15908383625,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -98.54534138,
            "band_gap": 0.2718000000000002,
            "is_gap_direct": false,
            "is_magnetic": true,
            "total_magnetization": 8.0003203,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:33.452000Z",
            "spacegroup": 53
        },
        {
            "id": "mp-20745",
            "created_at": "2022-09-04T14:44:28.526537Z",
            "structure_string": "Pb2\n1.0\n1.774194 -3.072994 0.000000\n1.774194 3.072994 0.000000\n0.000000 0.000000 5.841275\nPb\n2\ndirect\n0.333333 0.666667 0.250000 Pb\n0.666667 0.333333 0.750000 Pb\n",
            "nsites": 2,
            "nelements": 1,
            "elements": [
                "Pb"
            ],
            "chemical_system": "Pb",
            "density": 10.803597041477024,
            "density_atomic": 0.03139999137093524,
            "volume": 63.69428501981242,
            "volume_molar": 19.17879749984349,
            "formula_full": "Pb2",
            "formula_reduced": "Pb",
            "formula_anonymous": "A",
            "energy": -7.3967515,
            "energy_per_atom": -3.69837575,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -7.3967515,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0061659,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:41.518000Z",
            "spacegroup": 194
        },
        {
            "id": "mp-1096977",
            "created_at": "2022-09-04T14:44:29.481562Z",
            "structure_string": "H1\n1.0\n2.612964 0.000000 0.000000\n0.000000 2.612964 0.000000\n0.000000 0.000000 0.985799\nH\n1\ndirect\n0.000000 0.000000 0.500000 H\n",
            "nsites": 1,
            "nelements": 1,
            "elements": [
                "H"
            ],
            "chemical_system": "H",
            "density": 0.24867295324987948,
            "density_atomic": 0.14857466993999568,
            "volume": 6.730622389427931,
            "volume_molar": 4.053275543154253,
            "formula_full": "H1",
            "formula_reduced": "H",
            "formula_anonymous": "A",
            "energy": -3.00810299,
            "energy_per_atom": -3.00810299,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -3.00810299,
            "band_gap": 0.2567,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0001065,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:40.914000Z",
            "spacegroup": 123
        },
        {
            "id": "mp-1076920",
            "created_at": "2022-09-04T14:44:23.994667Z",
            "structure_string": "U1\n1.0\n1.433069 -2.482148 0.000000\n1.433069 2.482148 0.000000\n0.000000 0.000000 2.832045\nU\n1\ndirect\n0.000000 0.000000 0.000000 U\n",
            "nsites": 1,
            "nelements": 1,
            "elements": [
                "U"
            ],
            "chemical_system": "U",
            "density": 19.617961832382314,
            "density_atomic": 0.04963352040713929,
            "volume": 20.147674228970466,
            "volume_molar": 12.13321301934846,
            "formula_full": "U1",
            "formula_reduced": "U",
            "formula_anonymous": "A",
            "energy": -10.90615872,
            "energy_per_atom": -10.90615872,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -10.90615872,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0004642,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:36.155000Z",
            "spacegroup": 191
        },
        {
            "id": "mp-569423",
            "created_at": "2022-09-04T14:44:25.283106Z",
            "structure_string": "Ga6\n1.0\n-3.044339 3.044339 3.044339\n3.044339 -3.044339 3.044339\n3.044339 3.044339 -3.044339\nGa\n6\ndirect\n0.750000 0.875000 0.125000 Ga\n0.375000 0.250000 0.625000 Ga\n0.250000 0.625000 0.375000 Ga\n0.875000 0.125000 0.750000 Ga\n0.625000 0.375000 0.250000 Ga\n0.125000 0.750000 0.875000 Ga\n",
            "nsites": 6,
            "nelements": 1,
            "elements": [
                "Ga"
            ],
            "chemical_system": "Ga",
            "density": 6.155132240124962,
            "density_atomic": 0.05316333599996591,
            "volume": 112.85973476163812,
            "volume_molar": 11.327620147847496,
            "formula_full": "Ga6",
            "formula_reduced": "Ga",
            "formula_anonymous": "A",
            "energy": -18.10051829,
            "energy_per_atom": -3.0167530483333334,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -18.10051829,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0009317,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:38.156000Z",
            "spacegroup": 220
        },
        {
            "id": "mp-1191581",
            "created_at": "2022-09-04T14:44:27.151999Z",
            "structure_string": "W25\n1.0\n0.000000 -2.633443 0.000000\n-9.067128 0.000000 2.475199\n3.450759 0.000000 -19.878079\nW\n25\ndirect\n0.500000 0.500000 0.000000 W\n0.500000 0.876101 0.920977 W\n0.500000 0.123899 0.079023 W\n0.500000 0.611707 0.391789 W\n0.500000 0.388293 0.608211 W\n0.500000 0.941167 0.803121 W\n0.500000 0.058833 0.196879 W\n0.500000 0.630061 0.764373 W\n0.500000 0.369939 0.235627 W\n0.500000 0.565166 0.882696 W\n0.500000 0.434834 0.117304 W\n0.500000 0.921449 0.428007 W\n0.500000 0.078551 0.571993 W\n0.500000 0.991001 0.311966 W\n0.500000 0.008999 0.688034 W\n0.500000 0.813085 0.039213 W\n0.500000 0.186915 0.960787 W\n0.500000 0.768578 0.534235 W\n0.500000 0.231422 0.465765 W\n0.500000 0.694871 0.646657 W\n0.500000 0.305129 0.353343 W\n0.500000 0.746121 0.155816 W\n0.500000 0.253879 0.844184 W\n0.500000 0.678883 0.273267 W\n0.500000 0.321117 0.726733 W\n",
            "nsites": 25,
            "nelements": 1,
            "elements": [
                "W"
            ],
            "chemical_system": "W",
            "density": 16.878956556983074,
            "density_atomic": 0.05529125995605104,
            "volume": 452.1510274837573,
            "volume_molar": 10.891668529143258,
            "formula_full": "W25",
            "formula_reduced": "W",
            "formula_anonymous": "A",
            "energy": -294.42533286,
            "energy_per_atom": -11.777013314400001,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -294.42533286,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0003679,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:42.707000Z",
            "spacegroup": 10
        },
        {
            "id": "mp-1196583",
            "created_at": "2022-09-04T14:44:27.728948Z",
            "structure_string": "C240\n1.0\n14.295700 0.000000 0.000000\n0.000000 14.295700 0.000000\n-0.000000 -0.000000 14.295700\nC\n240\ndirect\n0.399630 0.724993 0.967534 C\n0.600371 0.224993 0.532466 C\n0.100371 0.275007 0.467534 C\n0.899629 0.775007 0.032466 C\n0.967534 0.399630 0.724993 C\n0.532466 0.600371 0.224993 C\n0.467534 0.100371 0.275007 C\n0.032466 0.899629 0.775007 C\n0.724993 0.967534 0.399630 C\n0.224993 0.532466 0.600371 C\n0.275007 0.467534 0.100371 C\n0.775007 0.032466 0.899629 C\n0.600371 0.275007 0.032466 C\n0.399630 0.775007 0.467534 C\n0.899629 0.724993 0.532466 C\n0.100371 0.224993 0.967534 C\n0.032466 0.600371 0.275007 C\n0.467534 0.399630 0.775007 C\n0.532466 0.899629 0.724993 C\n0.967534 0.100371 0.224993 C\n0.275007 0.032466 0.600371 C\n0.775007 0.467534 0.399630 C\n0.724993 0.532466 0.899629 C\n0.224993 0.967534 0.100371 C\n0.493610 0.742233 0.946052 C\n0.506390 0.242233 0.553948 C\n0.006390 0.257767 0.446052 C\n0.993610 0.757767 0.053948 C\n0.946052 0.493610 0.742233 C\n0.553948 0.506390 0.242233 C\n0.446052 0.006390 0.257767 C\n0.053948 0.993610 0.757767 C\n0.742233 0.946052 0.493610 C\n0.242233 0.553948 0.506390 C\n0.257767 0.446052 0.006390 C\n0.757767 0.053948 0.993610 C\n0.506390 0.257767 0.053948 C\n0.493610 0.757767 0.446052 C\n0.993610 0.742233 0.553948 C\n0.006390 0.242233 0.946052 C\n0.053948 0.506390 0.257767 C\n0.446052 0.493610 0.757767 C\n0.553948 0.993610 0.742233 C\n0.946052 0.006390 0.242233 C\n0.257767 0.053948 0.506390 C\n0.757767 0.446052 0.493610 C\n0.742233 0.553948 0.993610 C\n0.242233 0.946052 0.006390 C\n0.372164 0.704062 0.063137 C\n0.627836 0.204062 0.436863 C\n0.127836 0.295938 0.563137 C\n0.872164 0.795938 0.936863 C\n0.063137 0.372164 0.704062 C\n0.436863 0.627836 0.204062 C\n0.563137 0.127836 0.295938 C\n0.936863 0.872164 0.795938 C\n0.704062 0.063137 0.372164 C\n0.204062 0.436863 0.627836 C\n0.295938 0.563137 0.127836 C\n0.795938 0.936863 0.872164 C\n0.627836 0.295938 0.936863 C\n0.372164 0.795938 0.563137 C\n0.872164 0.704062 0.436863 C\n0.127836 0.204062 0.063137 C\n0.936863 0.627836 0.295938 C\n0.563137 0.372164 0.795938 C\n0.436863 0.872164 0.704062 C\n0.063137 0.127836 0.204062 C\n0.295938 0.936863 0.627836 C\n0.795938 0.563137 0.372164 C\n0.704062 0.436863 0.872164 C\n0.204062 0.063137 0.127836 C\n0.534812 0.703117 0.861609 C\n0.465188 0.203117 0.638391 C\n0.965188 0.296883 0.361609 C\n0.034812 0.796883 0.138391 C\n0.861609 0.534812 0.703117 C\n0.638391 0.465188 0.203117 C\n0.361609 0.965188 0.296883 C\n0.138391 0.034812 0.796883 C\n0.703117 0.861609 0.534812 C\n0.203117 0.638391 0.465188 C\n0.296883 0.361609 0.965188 C\n0.796883 0.138391 0.034812 C\n0.465188 0.296883 0.138391 C\n0.534812 0.796883 0.361609 C\n0.034812 0.703117 0.638391 C\n0.965188 0.203117 0.861609 C\n0.138391 0.465188 0.296883 C\n0.361609 0.534812 0.796883 C\n0.638391 0.034812 0.703117 C\n0.861609 0.965188 0.203117 C\n0.296883 0.138391 0.465188 C\n0.796883 0.361609 0.534812 C\n0.703117 0.638391 0.034812 C\n0.203117 0.861609 0.965188 C\n0.342974 0.667929 0.905323 C\n0.657026 0.167929 0.594677 C\n0.157026 0.332071 0.405323 C\n0.842974 0.832071 0.094677 C\n0.905323 0.342974 0.667929 C\n0.594677 0.657026 0.167929 C\n0.405323 0.157026 0.332071 C\n0.094677 0.842974 0.832071 C\n0.667929 0.905323 0.342974 C\n0.167929 0.594677 0.657026 C\n0.332071 0.405323 0.157026 C\n0.832071 0.094677 0.842974 C\n0.657026 0.332071 0.094677 C\n0.342974 0.832071 0.405323 C\n0.842974 0.667929 0.594677 C\n0.157026 0.167929 0.905323 C\n0.094677 0.657026 0.332071 C\n0.405323 0.342974 0.832071 C\n0.594677 0.842974 0.667929 C\n0.905323 0.157026 0.167929 C\n0.332071 0.094677 0.657026 C\n0.832071 0.405323 0.342974 C\n0.667929 0.594677 0.842974 C\n0.167929 0.905323 0.157026 C\n0.537444 0.719521 0.111461 C\n0.462556 0.219521 0.388539 C\n0.962556 0.280479 0.611461 C\n0.037444 0.780479 0.888539 C\n0.111461 0.537444 0.719521 C\n0.388539 0.462556 0.219521 C\n0.611461 0.962556 0.280479 C\n0.888539 0.037444 0.780479 C\n0.719521 0.111461 0.537444 C\n0.219521 0.388539 0.462556 C\n0.280479 0.611461 0.962556 C\n0.780479 0.888539 0.037444 C\n0.462556 0.280479 0.888539 C\n0.537444 0.780479 0.611461 C\n0.037444 0.719521 0.388539 C\n0.962556 0.219521 0.111461 C\n0.888539 0.462556 0.280479 C\n0.611461 0.537444 0.780479 C\n0.388539 0.037444 0.719521 C\n0.111461 0.962556 0.219521 C\n0.280479 0.888539 0.462556 C\n0.780479 0.611461 0.537444 C\n0.719521 0.388539 0.037444 C\n0.219521 0.111461 0.962556 C\n0.563828 0.739695 0.019254 C\n0.436172 0.239695 0.480746 C\n0.936172 0.260305 0.519254 C\n0.063828 0.760305 0.980746 C\n0.019254 0.563828 0.739695 C\n0.480746 0.436172 0.239695 C\n0.519254 0.936172 0.260305 C\n0.980746 0.063828 0.760305 C\n0.739695 0.019254 0.563828 C\n0.239695 0.480746 0.436172 C\n0.260305 0.519254 0.936172 C\n0.760305 0.980746 0.063828 C\n0.436172 0.260305 0.980746 C\n0.563828 0.760305 0.519254 C\n0.063828 0.739695 0.480746 C\n0.936172 0.239695 0.019254 C\n0.980746 0.436172 0.260305 C\n0.519254 0.563828 0.760305 C\n0.480746 0.063828 0.739695 C\n0.019254 0.936172 0.239695 C\n0.260305 0.980746 0.436172 C\n0.760305 0.519254 0.563828 C\n0.739695 0.480746 0.063828 C\n0.239695 0.019254 0.936172 C\n0.439913 0.701311 0.133825 C\n0.560087 0.201311 0.366175 C\n0.060087 0.298689 0.633825 C\n0.939913 0.798689 0.866175 C\n0.133825 0.439913 0.701311 C\n0.366175 0.560087 0.201311 C\n0.633825 0.060087 0.298689 C\n0.866175 0.939913 0.798689 C\n0.701311 0.133825 0.439913 C\n0.201311 0.366175 0.560087 C\n0.298689 0.633825 0.060087 C\n0.798689 0.866175 0.939913 C\n0.560087 0.298689 0.866175 C\n0.439913 0.798689 0.633825 C\n0.939913 0.701311 0.366175 C\n0.060087 0.201311 0.133825 C\n0.866175 0.560087 0.298689 C\n0.633825 0.439913 0.798689 C\n0.366175 0.939913 0.701311 C\n0.133825 0.060087 0.201311 C\n0.298689 0.866175 0.560087 C\n0.798689 0.633825 0.439913 C\n0.701311 0.366175 0.939913 C\n0.201311 0.133825 0.060087 C\n0.480226 0.648184 0.801623 C\n0.519774 0.148184 0.698377 C\n0.019774 0.351816 0.301623 C\n0.980226 0.851816 0.198377 C\n0.801623 0.480226 0.648184 C\n0.698377 0.519774 0.148184 C\n0.301623 0.019774 0.351816 C\n0.198377 0.980226 0.851816 C\n0.648184 0.801623 0.480226 C\n0.148184 0.698377 0.519774 C\n0.351816 0.301623 0.019774 C\n0.851816 0.198377 0.980226 C\n0.519774 0.351816 0.198377 C\n0.480226 0.851816 0.301623 C\n0.980226 0.648184 0.698377 C\n0.019774 0.148184 0.801623 C\n0.198377 0.519774 0.351816 C\n0.301623 0.480226 0.851816 C\n0.698377 0.980226 0.648184 C\n0.801623 0.019774 0.148184 C\n0.351816 0.198377 0.519774 C\n0.851816 0.301623 0.480226 C\n0.648184 0.698377 0.980226 C\n0.148184 0.801623 0.019774 C\n0.382696 0.630239 0.823966 C\n0.617304 0.130239 0.676034 C\n0.117304 0.369761 0.323966 C\n0.882696 0.869761 0.176034 C\n0.823966 0.382696 0.630239 C\n0.676034 0.617304 0.130239 C\n0.323966 0.117304 0.369761 C\n0.176034 0.882696 0.869761 C\n0.630239 0.823966 0.382696 C\n0.130239 0.676034 0.617304 C\n0.369761 0.323966 0.117304 C\n0.869761 0.176034 0.882696 C\n0.617304 0.369761 0.176034 C\n0.382696 0.869761 0.323966 C\n0.882696 0.630239 0.676034 C\n0.117304 0.130239 0.823966 C\n0.176034 0.617304 0.369761 C\n0.323966 0.382696 0.869761 C\n0.676034 0.882696 0.630239 C\n0.823966 0.117304 0.130239 C\n0.369761 0.176034 0.617304 C\n0.869761 0.323966 0.382696 C\n0.630239 0.676034 0.882696 C\n0.130239 0.823966 0.117304 C\n",
            "nsites": 240,
            "nelements": 1,
            "elements": [
                "C"
            ],
            "chemical_system": "C",
            "density": 1.6383714871150652,
            "density_atomic": 0.0821476160089512,
            "volume": 2921.569872141493,
            "volume_molar": 7.33087708758803,
            "formula_full": "C240",
            "formula_reduced": "C",
            "formula_anonymous": "A",
            "energy": -2122.47105768,
            "energy_per_atom": -8.843629407,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -2122.47105768,
            "band_gap": 1.3604,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 0.0,
            "is_theoretical": false,
            "updated_at": "2021-11-28T01:36:39.046000Z",
            "spacegroup": 205
        },
        {
            "id": "mp-8634",
            "created_at": "2022-09-04T14:44:28.485102Z",
            "structure_string": "Mn1\n1.0\n0.000000 1.754756 1.754756\n1.754756 0.000000 1.754756\n1.754756 1.754756 0.000000\nMn\n1\ndirect\n0.000000 0.000000 0.000000 Mn\n",
            "nsites": 1,
            "nelements": 1,
            "elements": [
                "Mn"
            ],
            "chemical_system": "Mn",
            "density": 8.441936758418016,
            "density_atomic": 0.09253793334615407,
            "volume": 10.806379220285026,
            "volume_molar": 6.507753677049546,
            "formula_full": "Mn1",
            "formula_reduced": "Mn",
            "formula_anonymous": "A",
            "energy": -9.07891724,
            "energy_per_atom": -9.07891724,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -9.07891724,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0189602,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:42.770000Z",
            "spacegroup": 225
        },
        {
            "id": "mp-8635",
            "created_at": "2022-09-04T14:44:40.433193Z",
            "structure_string": "Zr1\n1.0\n0.000000 2.268399 2.268399\n2.268399 0.000000 2.268399\n2.268399 2.268399 0.000000\nZr\n1\ndirect\n0.000000 0.000000 0.000000 Zr\n",
            "nsites": 1,
            "nelements": 1,
            "elements": [
                "Zr"
            ],
            "chemical_system": "Zr",
            "density": 6.4888819257318415,
            "density_atomic": 0.04283627153521132,
            "volume": 23.344702145190254,
            "volume_molar": 14.058508231860968,
            "formula_full": "Zr1",
            "formula_reduced": "Zr",
            "formula_anonymous": "A",
            "energy": -8.50843689,
            "energy_per_atom": -8.50843689,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -8.50843689,
            "band_gap": 0.0,
            "is_gap_direct": false,
            "is_magnetic": false,
            "total_magnetization": 0.0025517,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:37:01.957000Z",
            "spacegroup": 225
        }
    ]
}