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=-formula_anonymous&page=12176",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=12174",
"results": [
{
"id": "mp-112",
"created_at": "2022-09-04T14:44:20.558165Z",
"structure_string": "Y2\n1.0\n1.829494 -3.168776 0.000000\n1.829494 3.168776 0.000000\n0.000000 0.000000 5.665965\nY\n2\ndirect\n0.333333 0.666667 0.250000 Y\n0.666667 0.333333 0.750000 Y\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.494516911194183,
"density_atomic": 0.03044413106310264,
"volume": 65.69410688235865,
"volume_molar": 19.78095793740243,
"formula_full": "Y2",
"formula_reduced": "Y",
"formula_anonymous": "A",
"energy": -12.92584295,
"energy_per_atom": -6.462921475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.92584295,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.7334585,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:37.344000Z",
"spacegroup": 194
},
{
"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-999200",
"created_at": "2022-09-04T14:44:20.302036Z",
"structure_string": "Si4\n1.0\n-3.345046 3.345046 1.931045\n3.345046 -3.345046 1.931045\n3.345046 3.345046 -1.931045\nSi\n4\ndirect\n0.178625 0.178625 0.357251 Si\n0.821375 0.821375 0.642749 Si\n0.821375 0.178625 0.000000 Si\n0.178625 0.821375 0.000000 Si\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Si"
],
"chemical_system": "Si",
"density": 2.1584136263449913,
"density_atomic": 0.046281072726650795,
"volume": 86.42842017999756,
"volume_molar": 13.012102799709247,
"formula_full": "Si4",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy": -21.28886658,
"energy_per_atom": -5.322216645,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.28886658,
"band_gap": 0.4397999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.88e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:35.744000Z",
"spacegroup": 139
},
{
"id": "mp-1221597",
"created_at": "2022-09-04T14:44:20.720634Z",
"structure_string": "Na6\n1.0\n-5.961352 0.000000 -5.961352\n5.961352 -5.961352 0.000000\n-5.961352 -5.961352 0.000000\nNa\n6\ndirect\n0.500000 0.250000 0.250000 Na\n0.500000 0.750000 0.750000 Na\n0.796385 0.398193 0.805422 Na\n0.203615 0.398193 0.398193 Na\n0.203615 0.805422 0.398193 Na\n0.796385 0.398193 0.398193 Na\n",
"nsites": 6,
"nelements": 1,
"elements": [
"Na"
],
"chemical_system": "Na",
"density": 0.5405933087459964,
"density_atomic": 0.01416077282315193,
"volume": 423.7056885899896,
"volume_molar": 42.526921625027384,
"formula_full": "Na6",
"formula_reduced": "Na",
"formula_anonymous": "A",
"energy": -5.47045194,
"energy_per_atom": -0.91174199,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.47045194,
"band_gap": 0.2698,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0021229,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:21.157000Z",
"spacegroup": 216
},
{
"id": "mp-10765",
"created_at": "2022-09-04T14:44:42.412163Z",
"structure_string": "Ho1\n1.0\n0.000000 2.491822 2.491822\n2.491822 0.000000 2.491822\n2.491822 2.491822 0.000000\nHo\n1\ndirect\n0.000000 0.000000 0.000000 Ho\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ho"
],
"chemical_system": "Ho",
"density": 8.85051527311001,
"density_atomic": 0.0323161010004815,
"volume": 30.944327101375887,
"volume_molar": 18.63510935279684,
"formula_full": "Ho1",
"formula_reduced": "Ho",
"formula_anonymous": "A",
"energy": -4.55874995,
"energy_per_atom": -4.55874995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.55874995,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0029465,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:42.289000Z",
"spacegroup": 225
},
{
"id": "mp-1064227",
"created_at": "2022-09-04T14:44:42.184887Z",
"structure_string": "Ca2\n1.0\n1.946036 -3.393191 0.000000\n1.946036 3.393191 0.000000\n0.000000 0.000000 6.430438\nCa\n2\ndirect\n0.840980 0.159020 0.250000 Ca\n0.159020 0.840980 0.750000 Ca\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ca"
],
"chemical_system": "Ca",
"density": 1.567311811896212,
"density_atomic": 0.02355050738387993,
"volume": 84.92386033979797,
"volume_molar": 25.57117204244224,
"formula_full": "Ca2",
"formula_reduced": "Ca",
"formula_anonymous": "A",
"energy": -3.99692089,
"energy_per_atom": -1.998460445,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.99692089,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0153304,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:42.964000Z",
"spacegroup": 63
},
{
"id": "mp-1244987",
"created_at": "2022-09-04T14:47:27.348553Z",
"structure_string": "Zn100\n1.0\n11.706464 0.331444 -0.299754\n0.351417 11.811438 -0.491175\n-0.315011 -0.493333 11.703576\nZn\n100\ndirect\n0.948285 0.646914 0.594303 Zn\n0.291274 0.108757 0.100264 Zn\n0.964411 0.217735 0.407935 Zn\n0.269466 0.625166 0.240734 Zn\n0.225154 0.129736 0.453224 Zn\n0.433616 0.878988 0.645804 Zn\n0.624232 0.901217 0.137379 Zn\n0.171050 0.190993 0.812744 Zn\n0.270937 0.305378 0.998508 Zn\n0.541205 0.755882 0.466929 Zn\n0.672320 0.321084 0.521191 Zn\n0.532903 0.304867 0.201498 Zn\n0.212982 0.730141 0.930812 Zn\n0.105386 0.100778 0.236309 Zn\n0.629987 0.222644 0.867043 Zn\n0.745520 0.729052 0.555014 Zn\n0.046737 0.346787 0.920265 Zn\n0.441738 0.953009 0.007915 Zn\n0.299161 0.993844 0.285816 Zn\n0.688703 0.629864 0.329021 Zn\n0.877245 0.309494 0.608716 Zn\n0.563004 0.590595 0.942821 Zn\n0.327645 0.405733 0.217644 Zn\n0.048975 0.890931 0.966062 Zn\n0.080749 0.794999 0.522031 Zn\n0.918023 0.488491 0.765168 Zn\n0.906131 0.206894 0.184249 Zn\n0.522837 0.681755 0.709574 Zn\n0.080021 0.562025 0.900182 Zn\n0.142641 0.412151 0.730708 Zn\n0.597852 0.540733 0.546471 Zn\n0.701414 0.200549 0.082497 Zn\n0.936669 0.078216 0.820762 Zn\n0.191466 0.820283 0.727376 Zn\n0.895949 0.409804 0.298352 Zn\n0.075370 0.536630 0.288973 Zn\n0.744997 0.639252 0.769063 Zn\n0.482944 0.363497 0.987378 Zn\n0.691213 0.686121 0.112774 Zn\n0.727201 0.206465 0.323923 Zn\n0.890314 0.380860 0.068774 Zn\n0.309144 0.718323 0.489177 Zn\n0.514308 0.265806 0.658379 Zn\n0.868015 0.677952 0.972908 Zn\n0.150964 0.804236 0.309853 Zn\n0.868913 0.029580 0.048713 Zn\n0.890551 0.589253 0.164594 Zn\n0.153160 0.321506 0.359518 Zn\n0.428614 0.146693 0.919327 Zn\n0.245287 0.508901 0.431863 Zn\n0.167339 0.610376 0.635750 Zn\n0.992247 0.729707 0.800271 Zn\n0.393726 0.800997 0.844119 Zn\n0.459292 0.960095 0.434023 Zn\n0.671185 0.420333 0.331825 Zn\n0.463037 0.577592 0.343432 Zn\n0.363048 0.208145 0.309335 Zn\n0.233359 0.874779 0.108395 Zn\n0.080903 0.109903 0.000274 Zn\n0.942006 0.850069 0.165412 Zn\n0.930207 0.691010 0.372614 Zn\n0.834894 0.878675 0.883160 Zn\n0.295468 0.314479 0.560837 Zn\n0.086397 0.694439 0.105791 Zn\n0.383728 0.533563 0.599464 Zn\n0.458807 0.377283 0.433056 Zn\n0.408841 0.795963 0.275755 Zn\n0.517066 0.093048 0.177569 Zn\n0.866321 0.025869 0.286418 Zn\n0.760577 0.817856 0.286787 Zn\n0.633358 0.791105 0.928953 Zn\n0.715293 0.414482 0.729694 Zn\n0.544339 0.055086 0.735878 Zn\n0.356836 0.553076 0.035856 Zn\n0.089477 0.230159 0.603727 Zn\n0.662901 0.863149 0.733871 Zn\n0.253321 0.928930 0.518542 Zn\n0.696791 0.412878 0.970497 Zn\n0.812890 0.500414 0.493661 Zn\n0.338241 0.104170 0.662290 Zn\n0.509339 0.462074 0.770837 Zn\n0.055411 0.989602 0.411669 Zn\n0.034117 0.443929 0.519309 Zn\n0.254246 0.991185 0.872266 Zn\n0.865791 0.897187 0.464489 Zn\n0.847289 0.279643 0.853837 Zn\n0.729432 0.152539 0.676608 Zn\n0.347491 0.321658 0.791019 Zn\n0.576522 0.511396 0.149482 Zn\n0.903858 0.891344 0.679855 Zn\n0.538320 0.160799 0.459878 Zn\n0.448775 0.747834 0.065823 Zn\n0.660742 0.955969 0.548620 Zn\n0.913598 0.086603 0.578929 Zn\n0.656172 0.015915 0.943287 Zn\n0.652154 0.007986 0.339475 Zn\n0.307665 0.560570 0.811514 Zn\n0.101797 0.296390 0.143140 Zn\n0.112134 0.018598 0.676608 Zn\n0.156736 0.485994 0.082633 Zn\n",
"nsites": 100,
"nelements": 1,
"elements": [
"Zn"
],
"chemical_system": "Zn",
"density": 6.733494229205109,
"density_atomic": 0.061994603294552884,
"volume": 1613.0436309895128,
"volume_molar": 9.713975797840344,
"formula_full": "Zn100",
"formula_reduced": "Zn",
"formula_anonymous": "A",
"energy": -120.13688532,
"energy_per_atom": -1.2013688532,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -120.13688532,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:13.488000Z",
"spacegroup": 1
},
{
"id": "mp-58",
"created_at": "2022-09-04T14:47:28.022673Z",
"structure_string": "K1\n1.0\n-2.631059 2.631060 2.631060\n2.631059 -2.631060 2.631060\n2.631060 2.631060 -2.631059\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8911581989182845,
"density_atomic": 0.013726121379110086,
"volume": 72.85379258862663,
"volume_molar": 43.87357938685544,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -1.10082171,
"energy_per_atom": -1.10082171,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1.10082171,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003526,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:14.452000Z",
"spacegroup": 229
},
{
"id": "mp-672241",
"created_at": "2022-09-04T14:47:28.577637Z",
"structure_string": "Cs8\n1.0\n10.451807 0.000000 0.000000\n0.000000 10.451807 0.000000\n0.000000 0.000000 8.589615\nCs\n8\ndirect\n0.745934 0.438324 0.000000 Cs\n0.254066 0.561676 0.000000 Cs\n0.561676 0.745934 0.500000 Cs\n0.438324 0.254066 0.500000 Cs\n0.754066 0.938324 0.000000 Cs\n0.245934 0.061676 0.000000 Cs\n0.061676 0.754066 0.500000 Cs\n0.938324 0.245934 0.500000 Cs\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Cs"
],
"chemical_system": "Cs",
"density": 1.8815918325523924,
"density_atomic": 0.008525768288977678,
"volume": 938.3318580617064,
"volume_molar": 70.63458161049921,
"formula_full": "Cs8",
"formula_reduced": "Cs",
"formula_anonymous": "A",
"energy": -6.63945841,
"energy_per_atom": -0.82993230125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.63945841,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.040847,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:07.112000Z",
"spacegroup": 135
},
{
"id": "mp-1087546",
"created_at": "2022-09-04T14:47:34.137712Z",
"structure_string": "O8\n1.0\n4.565600 3.970196 0.000000\n-4.565600 3.970196 0.000000\n0.000000 2.164898 3.946012\nO\n8\ndirect\n0.711206 0.006915 0.606040 O\n0.993085 0.288794 0.893960 O\n0.288794 0.993085 0.393960 O\n0.006915 0.711206 0.106040 O\n0.598692 0.822027 0.860867 O\n0.177973 0.401308 0.639133 O\n0.401308 0.177973 0.139133 O\n0.822027 0.598692 0.360867 O\n",
"nsites": 8,
"nelements": 1,
"elements": [
"O"
],
"chemical_system": "O",
"density": 1.4857460231158937,
"density_atomic": 0.05592317016829473,
"volume": 143.05340659202378,
"volume_molar": 10.768596883683488,
"formula_full": "O8",
"formula_reduced": "O",
"formula_anonymous": "A",
"energy": -39.43974671,
"energy_per_atom": -4.92996833875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -39.43974671,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.0015409,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:10.661000Z",
"spacegroup": 15
},
{
"id": "mp-1244964",
"created_at": "2022-09-04T14:47:11.557466Z",
"structure_string": "C100\n1.0\n10.247851 -0.106168 0.008782\n-0.098855 10.894242 0.432224\n0.005544 0.456147 10.113102\nC\n100\ndirect\n0.880695 0.106943 0.226036 C\n0.721724 0.054992 0.910856 C\n0.869163 0.799839 0.010259 C\n0.923783 0.822262 0.127703 C\n0.336074 0.462276 0.463976 C\n0.902164 0.754814 0.616648 C\n0.737138 0.593871 0.646607 C\n0.873592 0.229270 0.792189 C\n0.452845 0.656236 0.768730 C\n0.911276 0.187923 0.666603 C\n0.264354 0.672831 0.911207 C\n0.111939 0.043947 0.976100 C\n0.372378 0.617000 0.259909 C\n0.345084 0.062971 0.269590 C\n0.809643 0.386208 0.561082 C\n0.581770 0.302167 0.239567 C\n0.257463 0.707812 0.046086 C\n0.409680 0.161492 0.187029 C\n0.230522 0.265357 0.410041 C\n0.039619 0.614130 0.382656 C\n0.925236 0.540734 0.354304 C\n0.302224 0.458753 0.830694 C\n0.870857 0.806702 0.494554 C\n0.679664 0.176342 0.916817 C\n0.581615 0.830157 0.247395 C\n0.292382 0.344199 0.505486 C\n0.667353 0.541004 0.075615 C\n0.266453 0.085062 0.730494 C\n0.861342 0.559323 0.232894 C\n0.786922 0.823267 0.907333 C\n0.383792 0.388135 0.746425 C\n0.224577 0.375605 0.044677 C\n0.119894 0.075228 0.766123 C\n0.232937 0.316741 0.279815 C\n0.358579 0.579383 0.878955 C\n0.373172 0.931949 0.288001 C\n0.452073 0.833570 0.286389 C\n0.485050 0.788904 0.792241 C\n0.070200 0.998062 0.103214 C\n0.768470 0.550597 0.150358 C\n0.086292 0.110444 0.530250 C\n0.252460 0.903428 0.363015 C\n0.826409 0.160710 0.331506 C\n0.744763 0.946424 0.899828 C\n0.583228 0.444154 0.883481 C\n0.627041 0.384477 0.337543 C\n0.656345 0.553543 0.561290 C\n0.663734 0.381320 0.777254 C\n0.797014 0.695636 0.705314 C\n0.367668 0.554357 0.547463 C\n0.698818 0.825661 0.225098 C\n0.349508 0.631879 0.124227 C\n0.323719 0.309704 0.645789 C\n0.810114 0.234355 0.432398 C\n0.029419 0.114361 0.647812 C\n0.660918 0.233415 0.153191 C\n0.145485 0.843150 0.904713 C\n0.074666 0.203964 0.155919 C\n0.378074 0.720131 0.354141 C\n0.446296 0.285819 0.224712 C\n0.869207 0.828825 0.371132 C\n0.335899 0.434050 0.094836 C\n0.543770 0.482754 0.368179 C\n0.596341 0.190462 0.034735 C\n0.135543 0.732745 0.707000 C\n0.238095 0.774936 0.384202 C\n0.859068 0.445727 0.433984 C\n0.121021 0.965493 0.872883 C\n0.175668 0.133869 0.435796 C\n0.727247 0.453465 0.651782 C\n0.162689 0.294958 0.158016 C\n0.075555 0.146216 0.887551 C\n0.752521 0.362148 0.399873 C\n0.032055 0.743678 0.646850 C\n0.453509 0.656416 0.480825 C\n0.587779 0.717918 0.808673 C\n0.162385 0.804064 0.044781 C\n0.566739 0.573373 0.455534 C\n0.009093 0.097428 0.167728 C\n0.767722 0.172325 0.205056 C\n0.355027 0.390155 0.237560 C\n0.065673 0.867900 0.124073 C\n0.413859 0.537742 0.025255 C\n0.416844 0.634335 0.629075 C\n0.835864 0.827057 0.241093 C\n0.482017 0.137327 0.078845 C\n0.565944 0.510061 0.000272 C\n0.400755 0.489265 0.324373 C\n0.846617 0.250860 0.561103 C\n0.425423 0.899897 0.767804 C\n0.191543 0.747674 0.828117 C\n0.217682 0.386903 0.907298 C\n0.967971 0.218076 0.889761 C\n0.310590 0.194658 0.690989 C\n0.735681 0.265537 0.827147 C\n0.350633 0.984966 0.744159 C\n0.129330 0.690814 0.391654 C\n0.731603 0.737308 0.810476 C\n0.514185 0.388961 0.789998 C\n0.236303 0.042703 0.358403 C\n",
"nsites": 100,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 1.7697928374749723,
"density_atomic": 0.08873705601669549,
"volume": 1126.924922787448,
"volume_molar": 6.786500510978143,
"formula_full": "C100",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy": -829.4068817900002,
"energy_per_atom": -8.294068817900001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -829.4068817900002,
"band_gap": 0.0724,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.0008597,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:59.504000Z",
"spacegroup": 1
},
{
"id": "mp-1246134",
"created_at": "2022-09-04T14:47:14.470580Z",
"structure_string": "Ni1\n1.0\n0.000000 0.000000 -2.338222\n-1.199048 -2.076812 0.000000\n-1.199048 2.076812 0.000000\nNi\n1\ndirect\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ni"
],
"chemical_system": "Ni",
"density": 8.369294959089133,
"density_atomic": 0.0858717885196815,
"volume": 11.645268105377864,
"volume_molar": 7.012944371852401,
"formula_full": "Ni1",
"formula_reduced": "Ni",
"formula_anonymous": "A",
"energy": -5.37022588,
"energy_per_atom": -5.37022588,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.37022588,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.4577781,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:59.220000Z",
"spacegroup": 191
}
]
}