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=-is_magnetic&page=10274",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-is_magnetic&page=10272",
"results": [
{
"id": "mp-29231",
"created_at": "2022-09-04T14:47:04.928852Z",
"structure_string": "Mo6 S6 Br2\n1.0\n4.468003 -4.808859 0.000000\n4.468003 4.808859 0.000000\n-0.707717 0.000000 6.525895\nMo S Br\n6 6 2\ndirect\n0.549362 0.408263 0.220375 Mo\n0.408263 0.220375 0.549362 Mo\n0.220375 0.549362 0.408263 Mo\n0.450638 0.591737 0.779625 Mo\n0.591737 0.779625 0.450638 Mo\n0.779625 0.450638 0.591737 Mo\n0.717440 0.134475 0.377357 S\n0.134475 0.377357 0.717440 S\n0.377357 0.717440 0.134475 S\n0.282560 0.865525 0.622643 S\n0.865525 0.622643 0.282560 S\n0.622643 0.282560 0.865525 S\n0.190677 0.190677 0.190677 Br\n0.809323 0.809323 0.809323 Br\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mo",
"S",
"Br"
],
"chemical_system": "Br-Mo-S",
"density": 5.49408881603104,
"density_atomic": 0.0499232050135049,
"volume": 280.43071345705494,
"volume_molar": 12.062808784754365,
"formula_full": "Mo6 S6 Br2",
"formula_reduced": "Mo3S3Br",
"formula_anonymous": "AB3C3",
"energy": -106.85213506,
"energy_per_atom": -7.632295361428571,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -102.76613506,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005854,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:54.011000Z",
"spacegroup": 148
},
{
"id": "mp-1228835",
"created_at": "2022-09-04T14:47:04.950884Z",
"structure_string": "Cs1 Hg1 Br2 Cl1\n1.0\n5.655472 0.000000 0.000000\n0.000000 5.655472 0.000000\n0.000000 0.000000 5.490166\nCs Hg Br Cl\n1 1 2 1\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.500000 Hg\n0.000000 0.500000 0.500000 Br\n0.500000 0.000000 0.500000 Br\n0.500000 0.500000 0.000000 Cl\n",
"nsites": 5,
"nelements": 4,
"elements": [
"Cs",
"Hg",
"Br",
"Cl"
],
"chemical_system": "Br-Cl-Cs-Hg",
"density": 5.0001333650165645,
"density_atomic": 0.028473890810322335,
"volume": 175.59946525423226,
"volume_molar": 21.149693942834315,
"formula_full": "Cs1 Hg1 Br2 Cl1",
"formula_reduced": "CsHgBr2Cl",
"formula_anonymous": "ABCD2",
"energy": -13.20773167,
"energy_per_atom": -2.641546334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.52573167,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0093715,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:54.496000Z",
"spacegroup": 123
},
{
"id": "mp-545622",
"created_at": "2022-09-04T14:47:05.098190Z",
"structure_string": "Zn2 W2 O8\n1.0\n6.674957 3.261162 0.000000\n-6.674957 3.261162 0.000000\n0.000000 3.240249 3.650087\nZn W O\n2 2 8\ndirect\n0.615369 0.384631 0.250000 Zn\n0.384631 0.615369 0.750000 Zn\n0.082706 0.917294 0.250000 W\n0.917294 0.082706 0.750000 W\n0.597041 0.930884 0.785891 O\n0.263736 0.176633 0.739540 O\n0.930884 0.597041 0.285891 O\n0.176633 0.263736 0.239540 O\n0.402959 0.069116 0.214109 O\n0.069116 0.402959 0.714109 O\n0.736264 0.823367 0.260460 O\n0.823367 0.736264 0.760460 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Zn",
"W",
"O"
],
"chemical_system": "O-W-Zn",
"density": 6.546533608625844,
"density_atomic": 0.07551395014951107,
"volume": 158.9110353284531,
"volume_molar": 7.974871858877311,
"formula_full": "Zn2 W2 O8",
"formula_reduced": "ZnWO4",
"formula_anonymous": "ABC4",
"energy": -92.18786592,
"energy_per_atom": -7.682322159999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -77.81586592,
"band_gap": 3.5246000000000004,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000553,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:51.549000Z",
"spacegroup": 15
},
{
"id": "mp-1373655",
"created_at": "2022-09-04T14:47:05.122400Z",
"structure_string": "Ca4 Ta2 Ti2 O12\n1.0\n7.822828 0.000000 0.000000\n0.000000 5.476848 0.000000\n0.000000 0.004695 5.635330\nCa Ta Ti O\n4 2 2 12\ndirect\n0.750000 0.989589 0.043345 Ca\n0.750000 0.511780 0.560799 Ca\n0.250000 0.488220 0.439201 Ca\n0.250000 0.010411 0.956655 Ca\n0.000000 0.000000 0.500000 Ta\n0.500000 0.000000 0.500000 Ta\n0.000000 0.500000 0.000000 Ti\n0.500000 0.500000 0.000000 Ti\n0.454057 0.201827 0.209537 O\n0.543972 0.706012 0.295617 O\n0.545943 0.798173 0.790463 O\n0.043972 0.293988 0.704383 O\n0.250000 0.912145 0.525911 O\n0.456028 0.293988 0.704383 O\n0.956028 0.706012 0.295617 O\n0.045943 0.201827 0.209537 O\n0.750000 0.416506 0.976649 O\n0.954057 0.798173 0.790463 O\n0.250000 0.583494 0.023351 O\n0.750000 0.087855 0.474089 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Ta",
"Ti",
"O"
],
"chemical_system": "Ca-O-Ta-Ti",
"density": 5.570384909028098,
"density_atomic": 0.08283543801647297,
"volume": 241.44255742358388,
"volume_molar": 7.2700053312960256,
"formula_full": "Ca4 Ta2 Ti2 O12",
"formula_reduced": "Ca2TaTiO6",
"formula_anonymous": "ABC2D6",
"energy": -175.8395923,
"energy_per_atom": -8.791979614999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -167.59559230000002,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0515907,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:51.406000Z",
"spacegroup": 11
},
{
"id": "mp-541238",
"created_at": "2022-09-04T14:47:10.320509Z",
"structure_string": "K2 Ti4 P6 O24\n1.0\n8.162890 -4.247200 0.000000\n8.162890 4.247200 0.000000\n5.953047 0.000000 7.016603\nK Ti P O\n2 4 6 24\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 K\n0.149500 0.149500 0.149500 Ti\n0.350500 0.350500 0.350500 Ti\n0.850500 0.850500 0.850500 Ti\n0.649500 0.649500 0.649500 Ti\n0.531862 0.968138 0.250000 P\n0.968138 0.250000 0.531862 P\n0.250000 0.531862 0.968138 P\n0.468138 0.031862 0.750000 P\n0.031862 0.750000 0.468138 P\n0.750000 0.468138 0.031862 P\n0.249137 0.510692 0.147711 O\n0.510692 0.147711 0.249137 O\n0.147711 0.249137 0.510692 O\n0.989308 0.250863 0.352289 O\n0.250863 0.352289 0.989308 O\n0.352289 0.989308 0.250863 O\n0.750863 0.489308 0.852289 O\n0.489308 0.852289 0.750863 O\n0.852289 0.750863 0.489308 O\n0.010692 0.749137 0.647711 O\n0.749137 0.647711 0.010692 O\n0.647711 0.010692 0.749137 O\n0.069571 0.703319 0.931969 O\n0.703319 0.931969 0.069571 O\n0.931969 0.069571 0.703319 O\n0.796681 0.430429 0.568031 O\n0.430429 0.568031 0.796681 O\n0.568031 0.796681 0.430429 O\n0.930429 0.296681 0.068031 O\n0.296681 0.068031 0.930429 O\n0.068031 0.930429 0.296681 O\n0.203319 0.569571 0.431969 O\n0.569571 0.431969 0.203319 O\n0.431969 0.203319 0.569571 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"K",
"Ti",
"P",
"O"
],
"chemical_system": "K-O-P-Ti",
"density": 2.8652498716202213,
"density_atomic": 0.07399441547967803,
"volume": 486.5232026853041,
"volume_molar": 8.138642248824754,
"formula_full": "K2 Ti4 P6 O24",
"formula_reduced": "KTi2(PO4)3",
"formula_anonymous": "AB2C3D12",
"energy": -294.2491487,
"energy_per_atom": -8.173587463888888,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -277.7611487,
"band_gap": 2.5455,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003849,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:57.434000Z",
"spacegroup": 167
},
{
"id": "mp-1361667",
"created_at": "2022-09-04T14:47:04.854063Z",
"structure_string": "Nd2 H24 N6 O30\n1.0\n6.872945 0.000000 0.000000\n-3.396756 8.642247 0.000000\n-0.237306 -4.401570 11.012042\nNd H N O\n2 24 6 30\ndirect\n0.875175 0.178657 0.224958 Nd\n0.124825 0.821343 0.775042 Nd\n0.284930 0.383813 0.973656 H\n0.715070 0.616187 0.026344 H\n0.215521 0.516904 0.009341 H\n0.784479 0.483096 0.990659 H\n0.819287 0.899338 0.449372 H\n0.180713 0.100662 0.550628 H\n0.730938 0.011545 0.507540 H\n0.269062 0.988455 0.492460 H\n0.141391 0.989861 0.121896 H\n0.858609 0.010139 0.878104 H\n0.251201 0.066329 0.206950 H\n0.748799 0.933671 0.793050 H\n0.313840 0.433438 0.225491 H\n0.686160 0.566562 0.774509 H\n0.175423 0.307686 0.364137 H\n0.824577 0.692314 0.635863 H\n0.602783 0.668480 0.197322 H\n0.397217 0.331519 0.802678 H\n0.468835 0.702942 0.117215 H\n0.531165 0.297058 0.882785 H\n0.011968 0.274977 0.559267 H\n0.988032 0.725023 0.440733 H\n0.275874 0.371178 0.517905 H\n0.724126 0.628822 0.482095 H\n0.424266 0.854940 0.323133 N\n0.575734 0.145060 0.676867 N\n0.742222 0.174773 0.997803 N\n0.257778 0.825227 0.002197 N\n0.734198 0.414096 0.315719 N\n0.265802 0.585904 0.684281 N\n0.186378 0.400995 0.040901 O\n0.813622 0.599005 0.959099 O\n0.808450 0.005925 0.430022 O\n0.191550 0.994075 0.569978 O\n0.130129 0.052032 0.176492 O\n0.869871 0.947968 0.823508 O\n0.188893 0.320981 0.278919 O\n0.811107 0.679019 0.721081 O\n0.536769 0.629676 0.141294 O\n0.463231 0.370324 0.858706 O\n0.156855 0.280165 0.510682 O\n0.843145 0.719835 0.489318 O\n0.421834 0.991954 0.328772 O\n0.578166 0.008046 0.671228 O\n0.616214 0.863405 0.269839 O\n0.383786 0.136595 0.730161 O\n0.247547 0.722207 0.367209 O\n0.752453 0.277793 0.632791 O\n0.689709 0.247488 0.070261 O\n0.310291 0.752512 0.929739 O\n0.854685 0.097457 0.019051 O\n0.145315 0.902543 0.980949 O\n0.682936 0.179338 0.909317 O\n0.317064 0.820662 0.090683 O\n0.849077 0.452170 0.203275 O\n0.150923 0.547830 0.796725 O\n0.686033 0.271540 0.388077 O\n0.313967 0.728460 0.611923 O\n0.670981 0.510505 0.351930 O\n0.329019 0.489495 0.648070 O\n",
"nsites": 62,
"nelements": 4,
"elements": [
"Nd",
"H",
"N",
"O"
],
"chemical_system": "H-N-Nd-O",
"density": 2.225671664961183,
"density_atomic": 0.09478820242331518,
"volume": 654.0898383441628,
"volume_molar": 6.353259800313216,
"formula_full": "Nd2 H24 N6 O30",
"formula_reduced": "NdH12(NO5)3",
"formula_anonymous": "AB3C12D15",
"energy": -303.36682219,
"energy_per_atom": -4.893013261129032,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -282.75682219,
"band_gap": 0.2562,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.4e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:47.053000Z",
"spacegroup": 2
},
{
"id": "mp-675946",
"created_at": "2022-09-04T14:47:04.858141Z",
"structure_string": "Li8 Mg4 Br16\n1.0\n6.289579 0.000000 0.000000\n0.000000 6.289579 0.000000\n0.000000 0.000000 8.516367\nLi Mg Br\n8 4 16\ndirect\n0.000000 0.252090 0.000000 Li\n0.747910 0.000000 0.750000 Li\n0.000000 0.747910 0.500000 Li\n0.000000 0.250445 0.500000 Li\n0.252090 0.000000 0.250000 Li\n0.250445 0.000000 0.750000 Li\n0.749555 0.000000 0.250000 Li\n0.000000 0.749555 0.000000 Li\n0.500000 0.249753 0.500000 Mg\n0.750247 0.500000 0.250000 Mg\n0.249753 0.500000 0.750000 Mg\n0.500000 0.750247 0.000000 Mg\n0.490718 0.246847 0.228348 Br\n0.753153 0.509282 0.521652 Br\n0.011245 0.246448 0.252479 Br\n0.988755 0.753552 0.752479 Br\n0.246448 0.011245 0.997521 Br\n0.246847 0.509282 0.478348 Br\n0.246847 0.490718 0.021652 Br\n0.509282 0.753153 0.728348 Br\n0.490718 0.753153 0.271652 Br\n0.753552 0.011245 0.002479 Br\n0.753552 0.988755 0.497521 Br\n0.753153 0.490718 0.978348 Br\n0.011245 0.753552 0.247521 Br\n0.988755 0.246448 0.747521 Br\n0.246448 0.988755 0.502479 Br\n0.509282 0.246847 0.771652 Br\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Br"
],
"chemical_system": "Br-Li-Mg",
"density": 7.05432631404367,
"density_atomic": 0.08311138316720851,
"volume": 336.89729292157136,
"volume_molar": 7.245867570130909,
"formula_full": "Li8 Mg4 Br16",
"formula_reduced": "Li2MgBr4",
"formula_anonymous": "AB2C4",
"energy": -53.12742441,
"energy_per_atom": -1.8974080146428574,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.58342441,
"band_gap": 3.7295,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.6e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:51.990000Z",
"spacegroup": 95
},
{
"id": "mp-1224396",
"created_at": "2022-09-04T14:47:04.860542Z",
"structure_string": "Ge2 As2 W2\n1.0\n1.659474 4.657036 0.000000\n-1.659474 4.657036 0.000000\n0.000000 3.870695 6.680933\nGe As W\n2 2 2\ndirect\n0.396276 0.396276 0.895609 Ge\n0.603724 0.603724 0.104391 Ge\n0.855752 0.855752 0.534363 As\n0.144248 0.144248 0.465637 As\n0.154307 0.154307 0.800118 W\n0.845693 0.845693 0.199882 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ge",
"As",
"W"
],
"chemical_system": "As-Ge-W",
"density": 10.65826549694284,
"density_atomic": 0.05810374038829834,
"volume": 103.26357580257184,
"volume_molar": 10.364463147733625,
"formula_full": "Ge2 As2 W2",
"formula_reduced": "GeAsW",
"formula_anonymous": "ABC",
"energy": -44.64784496,
"energy_per_atom": -7.441307493333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.64784496,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0019735,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:53.493000Z",
"spacegroup": 12
},
{
"id": "mp-1188565",
"created_at": "2022-09-04T14:47:04.942468Z",
"structure_string": "In10 Sb6\n1.0\n-4.087111 4.087111 6.815457\n4.087111 -4.087111 6.815457\n4.087111 4.087111 -6.815457\nIn Sb\n10 6\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.000000 In\n0.992456 0.492456 0.802833 In\n0.689623 0.189623 0.197167 In\n0.492456 0.689623 0.500000 In\n0.189623 0.992456 0.500000 In\n0.007544 0.507544 0.197167 In\n0.310377 0.810377 0.802833 In\n0.507544 0.310377 0.500000 In\n0.810377 0.007544 0.500000 In\n0.750000 0.750000 0.000000 Sb\n0.250000 0.250000 0.000000 Sb\n0.351233 0.851233 0.202466 Sb\n0.648767 0.148767 0.797534 Sb\n0.851233 0.648767 0.500000 Sb\n0.148767 0.351233 0.500000 Sb\n",
"nsites": 16,
"nelements": 2,
"elements": [
"In",
"Sb"
],
"chemical_system": "In-Sb",
"density": 6.850589438270663,
"density_atomic": 0.035134367842696426,
"volume": 455.39456043823503,
"volume_molar": 17.140313401858617,
"formula_full": "In10 Sb6",
"formula_reduced": "In5Sb3",
"formula_anonymous": "A3B5",
"energy": -52.86171629,
"energy_per_atom": -3.303857268125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.70971629,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0038547,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:56.098000Z",
"spacegroup": 140
},
{
"id": "mp-1094659",
"created_at": "2022-09-04T14:47:07.658254Z",
"structure_string": "Mg2 Ga4\n1.0\n1.557098 -7.347428 0.000000\n1.557098 7.347428 0.000000\n0.000000 0.000000 5.021647\nMg Ga\n2 4\ndirect\n0.440100 0.559900 0.250000 Mg\n0.559900 0.440100 0.750000 Mg\n0.113514 0.886486 0.250000 Ga\n0.773113 0.226887 0.250000 Ga\n0.226887 0.773113 0.750000 Ga\n0.886486 0.113514 0.750000 Ga\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ga"
],
"chemical_system": "Ga-Mg",
"density": 4.732990056118249,
"density_atomic": 0.05221842738696129,
"volume": 114.90196660917012,
"volume_molar": 11.532596942020705,
"formula_full": "Mg2 Ga4",
"formula_reduced": "MgGa2",
"formula_anonymous": "AB2",
"energy": -15.547972830000004,
"energy_per_atom": -2.5913288050000007,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.547972830000004,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.26e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:57.340000Z",
"spacegroup": 63
},
{
"id": "mp-1207601",
"created_at": "2022-09-04T14:47:07.864508Z",
"structure_string": "Y2 W2 Cl2 O8\n1.0\n4.952566 3.688086 -1.546501\n4.952566 -3.688086 -1.546501\n-0.013227 0.000000 -6.952293\nY W Cl O\n2 2 2 8\ndirect\n0.277902 0.277902 0.615963 Y\n0.722098 0.722098 0.384037 Y\n0.137238 0.137238 0.232389 W\n0.862762 0.862762 0.767611 W\n0.510706 0.510706 0.731617 Cl\n0.489294 0.489294 0.268383 Cl\n0.043987 0.043987 0.701885 O\n0.956013 0.956013 0.298115 O\n0.610151 0.990567 0.651302 O\n0.389849 0.009433 0.348698 O\n0.009433 0.389849 0.348698 O\n0.990567 0.610151 0.651302 O\n0.206408 0.206408 0.963802 O\n0.793592 0.793592 0.036198 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Y",
"W",
"Cl",
"O"
],
"chemical_system": "Cl-O-W-Y",
"density": 4.864116988533671,
"density_atomic": 0.055091009147792594,
"volume": 254.12495099594588,
"volume_molar": 10.931258753754918,
"formula_full": "Y2 W2 Cl2 O8",
"formula_reduced": "YWClO4",
"formula_anonymous": "ABCD4",
"energy": -120.52520424,
"energy_per_atom": -8.608943159999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -104.92520424,
"band_gap": 3.5918,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004544,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:57.605000Z",
"spacegroup": 12
},
{
"id": "mp-1936",
"created_at": "2022-09-04T14:47:08.084334Z",
"structure_string": "Ta2 As2\n1.0\n-1.734807 1.734807 5.867445\n1.734807 -1.734807 5.867445\n1.734807 1.734807 -5.867445\nTa As\n2 2\ndirect\n0.499936 0.999936 0.500000 Ta\n0.749936 0.749936 0.000000 Ta\n0.917764 0.417764 0.500000 As\n0.167764 0.167764 0.000000 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"As"
],
"chemical_system": "As-Ta",
"density": 12.030570688698356,
"density_atomic": 0.056630271133164246,
"volume": 70.63360142836204,
"volume_molar": 10.634137254683331,
"formula_full": "Ta2 As2",
"formula_reduced": "TaAs",
"formula_anonymous": "AB",
"energy": -35.17682402,
"energy_per_atom": -8.794206005,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.17682402,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.00032,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:51.406000Z",
"spacegroup": 109
}
]
}