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=131",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=129",
"results": [
{
"id": "mp-1521399",
"created_at": "2022-09-04T14:42:10.584055Z",
"structure_string": "K1 Gd1 Zr1 Ti1 O6\n1.0\n-0.000000 -4.036550 -4.036550\n4.036550 0.000000 -4.036550\n4.036550 -4.036550 0.000000\nK Gd Zr Ti O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Gd\n0.500000 0.500000 0.500000 Zr\n0.000000 -0.000000 0.000000 Ti\n0.757927 0.242073 0.242073 O\n0.242073 0.757927 0.757927 O\n0.757927 0.242073 0.757927 O\n0.242073 0.757927 0.242073 O\n0.757927 0.757927 0.242073 O\n0.242073 0.242073 0.757927 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Gd",
"Zr",
"Ti",
"O"
],
"chemical_system": "Gd-K-O-Ti-Zr",
"density": 5.446332749202431,
"density_atomic": 0.07602194823661859,
"volume": 131.54095931447276,
"volume_molar": 7.921581726971881,
"formula_full": "K1 Gd1 Zr1 Ti1 O6",
"formula_reduced": "KGdZrTiO6",
"formula_anonymous": "ABCDE6",
"energy": -94.38001746,
"energy_per_atom": -9.438001746000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -90.25801746,
"band_gap": 0.8262999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.9999999,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:41.408000Z",
"spacegroup": 216
},
{
"id": "mp-1516183",
"created_at": "2022-09-04T14:42:03.222493Z",
"structure_string": "Nd1 Eu1 Zr1 Ti1 O6\n1.0\n-0.000000 -4.055543 -4.055543\n4.055543 -0.000000 -4.055543\n4.055543 -4.055543 0.000000\nNd Eu Zr Ti O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Nd\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Zr\n-0.000000 -0.000000 0.000000 Ti\n0.756965 0.243035 0.243035 O\n0.243035 0.756965 0.756965 O\n0.756965 0.243035 0.756965 O\n0.243035 0.756965 0.243035 O\n0.756965 0.756965 0.243035 O\n0.243035 0.243035 0.756965 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Nd",
"Eu",
"Zr",
"Ti",
"O"
],
"chemical_system": "Eu-Nd-O-Ti-Zr",
"density": 6.61312133818165,
"density_atomic": 0.0749588599731376,
"volume": 133.40651129944638,
"volume_molar": 8.033927893457966,
"formula_full": "Nd1 Eu1 Zr1 Ti1 O6",
"formula_reduced": "NdEuZrTiO6",
"formula_anonymous": "ABCDE6",
"energy": -95.8146451,
"energy_per_atom": -9.58146451,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -91.6926451,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.844615,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.945000Z",
"spacegroup": 216
},
{
"id": "mp-1522429",
"created_at": "2022-09-04T14:42:10.060757Z",
"structure_string": "K1 La1 Dy1 Sb1 O6\n1.0\n0.000000 -4.186829 -4.186829\n4.186829 0.000000 -4.186829\n4.186829 -4.186829 0.000000\nK La Dy Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 La\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 Sb\n0.737391 0.262609 0.262609 O\n0.262609 0.737391 0.737391 O\n0.737391 0.262609 0.737391 O\n0.262609 0.737391 0.262609 O\n0.737391 0.737391 0.262609 O\n0.262609 0.262609 0.737391 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"La",
"Dy",
"Sb",
"O"
],
"chemical_system": "Dy-K-La-O-Sb",
"density": 6.315388535300789,
"density_atomic": 0.068126226391567,
"volume": 146.78634836638844,
"volume_molar": 8.839680515087872,
"formula_full": "K1 La1 Dy1 Sb1 O6",
"formula_reduced": "KLaDySbO6",
"formula_anonymous": "ABCDE6",
"energy": -73.40927449,
"energy_per_atom": -7.3409274490000005,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -69.28727449,
"band_gap": 2.394,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:41.598000Z",
"spacegroup": 216
},
{
"id": "mp-1521012",
"created_at": "2022-09-04T14:42:02.865171Z",
"structure_string": "Ba4 Sr4 Ca4 W4 O24\n1.0\n8.454494 0.000000 0.000000\n0.000000 8.425849 0.000000\n0.000000 0.000000 8.432947\nBa Sr Ca W O\n4 4 4 4 24\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.000000 -0.000000 Ba\n0.000000 0.500000 -0.000000 Ba\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.749713 0.749015 0.747956 Ca\n0.250287 0.250985 0.747956 Ca\n0.250287 0.749015 0.252044 Ca\n0.749713 0.250985 0.252044 Ca\n0.250668 0.249171 0.253913 W\n0.749332 0.750829 0.253913 W\n0.749332 0.249171 0.746087 W\n0.250668 0.750829 0.746087 W\n0.021354 0.218645 0.282985 O\n0.978646 0.781355 0.282985 O\n0.978646 0.218645 0.717015 O\n0.021354 0.781355 0.717015 O\n0.274843 0.019861 0.227787 O\n0.274843 0.980139 0.772213 O\n0.725157 0.980139 0.227787 O\n0.725157 0.019861 0.772213 O\n0.224687 0.271626 0.023203 O\n0.775313 0.271626 0.976797 O\n0.224687 0.728374 0.976797 O\n0.775313 0.728374 0.023203 O\n0.477880 0.287018 0.221242 O\n0.522120 0.712982 0.221242 O\n0.522120 0.287018 0.778758 O\n0.477880 0.712982 0.778758 O\n0.216563 0.477156 0.287195 O\n0.216563 0.522844 0.712805 O\n0.783437 0.522844 0.287195 O\n0.783437 0.477156 0.712805 O\n0.288606 0.218323 0.480384 O\n0.711394 0.218323 0.519616 O\n0.288606 0.781677 0.519616 O\n0.711394 0.781677 0.480384 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"Ba",
"Sr",
"Ca",
"W",
"O"
],
"chemical_system": "Ba-Ca-O-Sr-W",
"density": 6.024409265517236,
"density_atomic": 0.06658544834581885,
"volume": 600.7318564899585,
"volume_molar": 9.044229496996623,
"formula_full": "Ba4 Sr4 Ca4 W4 O24",
"formula_reduced": "BaSrCaWO6",
"formula_anonymous": "ABCDE6",
"energy": -313.9525564,
"energy_per_atom": -7.84881391,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -279.7125564,
"band_gap": 3.2474,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:28.540000Z",
"spacegroup": 16
},
{
"id": "mp-1519687",
"created_at": "2022-09-04T14:42:09.095862Z",
"structure_string": "Ba1 Cr1 In1 W1 O6\n1.0\n0.000000 -4.046543 -4.046543\n4.046543 0.000000 -4.046543\n4.046543 -4.046543 -0.000000\nBa Cr In W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n-0.000000 0.000000 -0.000000 Cr\n0.250000 0.250000 0.250000 In\n0.500000 0.500000 0.500000 W\n0.743748 0.256252 0.256252 O\n0.256252 0.743748 0.743748 O\n0.743748 0.256252 0.743748 O\n0.256252 0.743748 0.256252 O\n0.743748 0.743748 0.256252 O\n0.256252 0.256252 0.743748 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Cr",
"In",
"W",
"O"
],
"chemical_system": "Ba-Cr-In-O-W",
"density": 7.317500102586479,
"density_atomic": 0.07546012585128509,
"volume": 132.52031966800251,
"volume_molar": 7.980560186009077,
"formula_full": "Ba1 Cr1 In1 W1 O6",
"formula_reduced": "BaCrInWO6",
"formula_anonymous": "ABCDE6",
"energy": -79.31132226999999,
"energy_per_atom": -7.931132226999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -68.75232227,
"band_gap": 0.1824000000000003,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.9999999,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:38.481000Z",
"spacegroup": 216
},
{
"id": "mp-1518608",
"created_at": "2022-09-04T14:42:07.744917Z",
"structure_string": "Sr1 Hf1 Ti1 In1 O6\n1.0\n0.000000 -4.034614 -4.034614\n4.034614 -0.000000 -4.034614\n4.034614 -4.034614 0.000000\nSr Hf Ti In O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n-0.000000 0.000000 -0.000000 Hf\n0.500000 0.500000 0.500000 Ti\n0.250000 0.250000 0.250000 In\n0.744037 0.255963 0.255963 O\n0.255963 0.744037 0.744037 O\n0.744037 0.255963 0.744037 O\n0.255963 0.744037 0.255963 O\n0.744037 0.744037 0.255963 O\n0.255963 0.255963 0.744037 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Hf",
"Ti",
"In",
"O"
],
"chemical_system": "Hf-In-O-Sr-Ti",
"density": 6.634372278637812,
"density_atomic": 0.07613143761503292,
"volume": 131.35178203997816,
"volume_molar": 7.910189205215884,
"formula_full": "Sr1 Hf1 Ti1 In1 O6",
"formula_reduced": "SrHfTiInO6",
"formula_anonymous": "ABCDE6",
"energy": -83.23596666,
"energy_per_atom": -8.323596666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -79.11396666,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.68e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.586000Z",
"spacegroup": 216
},
{
"id": "mp-1517440",
"created_at": "2022-09-04T14:42:04.504522Z",
"structure_string": "Ba1 Nd1 Cr1 Sn1 O6\n1.0\n-0.000000 -4.055025 -4.055025\n4.055025 0.000000 -4.055025\n4.055025 -4.055025 -0.000000\nBa Nd Cr Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Nd\n-0.000000 0.000000 -0.000000 Cr\n0.500000 0.500000 0.500000 Sn\n0.753220 0.246780 0.246780 O\n0.246780 0.753220 0.753220 O\n0.753220 0.246780 0.753220 O\n0.246780 0.753220 0.246780 O\n0.753220 0.753220 0.246780 O\n0.246780 0.246780 0.753220 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Nd",
"Cr",
"Sn",
"O"
],
"chemical_system": "Ba-Cr-Nd-O-Sn",
"density": 6.827066996804177,
"density_atomic": 0.07498758999312055,
"volume": 133.35539921895625,
"volume_molar": 8.030849852025487,
"formula_full": "Ba1 Nd1 Cr1 Sn1 O6",
"formula_reduced": "BaNdCrSnO6",
"formula_anonymous": "ABCDE6",
"energy": -77.143778,
"energy_per_atom": -7.714377799999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -71.022778,
"band_gap": 1.922,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.9999999,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:39.269000Z",
"spacegroup": 216
},
{
"id": "mp-1519055",
"created_at": "2022-09-04T14:42:11.235769Z",
"structure_string": "K4 Nd4 Eu4 W4 O24\n1.0\n8.489941 0.000000 0.000000\n0.000000 8.483808 0.000000\n0.000000 0.000000 8.513525\nK Nd Eu W O\n4 4 4 4 24\ndirect\n-0.000000 0.500000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.500000 0.000000 0.000000 K\n-0.000000 -0.000000 0.500000 K\n0.750000 0.750000 0.750000 Nd\n0.250000 0.250000 0.750000 Nd\n0.250000 0.750000 0.250000 Nd\n0.750000 0.250000 0.250000 Nd\n0.500000 0.000000 0.500000 Eu\n-0.000000 0.500000 -0.000000 Eu\n-0.000000 -0.000000 0.000000 Eu\n0.500000 0.500000 0.500000 Eu\n0.250000 0.250000 0.250000 W\n0.750000 0.750000 0.250000 W\n0.750000 0.250000 0.750000 W\n0.250000 0.750000 0.750000 W\n0.022897 0.220740 0.267826 O\n0.977103 0.779260 0.267826 O\n0.977103 0.220740 0.732174 O\n0.022897 0.779260 0.732174 O\n0.273420 0.022722 0.222402 O\n0.273420 0.977278 0.777598 O\n0.726580 0.977278 0.222402 O\n0.726580 0.022722 0.777598 O\n0.211089 0.276187 0.021934 O\n0.788911 0.276187 0.978066 O\n0.211089 0.723813 0.978066 O\n0.788911 0.723813 0.021934 O\n0.477103 0.279260 0.232174 O\n0.522897 0.720740 0.232174 O\n0.522897 0.279260 0.767826 O\n0.477103 0.720740 0.767826 O\n0.226580 0.477278 0.277598 O\n0.226580 0.522722 0.722402 O\n0.773420 0.522722 0.277598 O\n0.773420 0.477278 0.722402 O\n0.288911 0.223813 0.478066 O\n0.711089 0.223813 0.521934 O\n0.288911 0.776187 0.521934 O\n0.711089 0.776187 0.478066 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"K",
"Nd",
"Eu",
"W",
"O"
],
"chemical_system": "Eu-K-Nd-O-W",
"density": 6.663135302182496,
"density_atomic": 0.06523115558202364,
"volume": 613.2039152625892,
"volume_molar": 9.232000730736063,
"formula_full": "K4 Nd4 Eu4 W4 O24",
"formula_reduced": "KNdEuWO6",
"formula_anonymous": "ABCDE6",
"energy": -349.0847691,
"energy_per_atom": -8.727119227500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -314.8447691,
"band_gap": 0.173,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 27.9999977,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:38.344000Z",
"spacegroup": 48
},
{
"id": "mp-1522018",
"created_at": "2022-09-04T14:42:02.568776Z",
"structure_string": "K1 Pr1 Al1 Bi1 O6\n1.0\n0.000000 -4.009601 -4.009601\n4.009601 0.000000 -4.009601\n4.009601 -4.009601 0.000000\nK Pr Al Bi O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 Pr\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Bi\n0.761617 0.238383 0.238383 O\n0.238383 0.761617 0.761617 O\n0.761617 0.238383 0.761617 O\n0.238383 0.761617 0.238383 O\n0.761617 0.761617 0.238383 O\n0.238383 0.238383 0.761617 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Pr",
"Al",
"Bi",
"O"
],
"chemical_system": "Al-Bi-K-O-Pr",
"density": 6.594096482624454,
"density_atomic": 0.07756513120416986,
"volume": 128.92391007084902,
"volume_molar": 7.763979337762343,
"formula_full": "K1 Pr1 Al1 Bi1 O6",
"formula_reduced": "KPrAlBiO6",
"formula_anonymous": "ABCDE6",
"energy": -67.39928799,
"energy_per_atom": -6.739928799,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -63.27728799,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:40.011000Z",
"spacegroup": 216
},
{
"id": "mp-1519650",
"created_at": "2022-09-04T14:42:10.265359Z",
"structure_string": "Ba1 Pr1 Eu1 W1 O6\n1.0\n0.000000 -4.329289 -4.329289\n4.329289 -0.000000 -4.329289\n4.329289 -4.329289 0.000000\nBa Pr Eu W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n-0.000000 -0.000000 -0.000000 Pr\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 W\n0.730316 0.269684 0.269684 O\n0.269684 0.730316 0.730316 O\n0.730316 0.269684 0.730316 O\n0.269684 0.730316 0.269684 O\n0.730316 0.730316 0.269684 O\n0.269684 0.269684 0.730316 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Pr",
"Eu",
"W",
"O"
],
"chemical_system": "Ba-Eu-O-Pr-W",
"density": 7.265226454340521,
"density_atomic": 0.06161979803170866,
"volume": 162.28550432531674,
"volume_molar": 9.773061503546462,
"formula_full": "Ba1 Pr1 Eu1 W1 O6",
"formula_reduced": "BaPrEuWO6",
"formula_anonymous": "ABCDE6",
"energy": -88.59146695,
"energy_per_atom": -8.859146695,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -80.03146695,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.9999999,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:47.746000Z",
"spacegroup": 216
},
{
"id": "mp-1517626",
"created_at": "2022-09-04T14:42:07.326751Z",
"structure_string": "K1 Ca1 Nb1 Bi1 O6\n1.0\n-0.000000 -4.213273 -4.213273\n4.213273 0.000000 -4.213273\n4.213273 -4.213273 -0.000000\nK Ca Nb Bi O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 Bi\n0.737576 0.262424 0.262424 O\n0.262424 0.737576 0.737576 O\n0.737576 0.262424 0.737576 O\n0.262424 0.737576 0.262424 O\n0.737576 0.737576 0.262424 O\n0.262424 0.262424 0.737576 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Ca",
"Nb",
"Bi",
"O"
],
"chemical_system": "Bi-Ca-K-Nb-O",
"density": 5.295815318571057,
"density_atomic": 0.06685150727624234,
"volume": 149.58525854440677,
"volume_molar": 9.008234825754103,
"formula_full": "K1 Ca1 Nb1 Bi1 O6",
"formula_reduced": "KCaNbBiO6",
"formula_anonymous": "ABCDE6",
"energy": -70.77962269,
"energy_per_atom": -7.0779622689999995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -66.65762269,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:31.162000Z",
"spacegroup": 216
},
{
"id": "mp-1227411",
"created_at": "2022-09-04T14:42:10.566837Z",
"structure_string": "Ba2 Sr2 Ni2 W2 O12\n1.0\n-4.054829 -0.000001 -4.054836\n-0.000038 -4.054801 -4.054799\n-4.054745 -8.109591 4.054751\nBa Sr Ni W O\n2 2 2 2 12\ndirect\n0.125000 0.750000 0.375001 Ba\n0.625000 0.750002 0.874999 Ba\n0.374999 0.250001 0.125000 Sr\n0.875001 0.250000 0.625001 Sr\n0.250003 0.500004 0.749999 Ni\n0.749998 0.499996 0.250003 Ni\n0.500001 0.999998 0.500003 W\n0.999999 0.000003 0.999996 W\n0.138494 0.241005 0.379496 O\n0.638493 0.241004 0.879498 O\n0.620501 0.241004 0.379497 O\n0.120502 0.241006 0.879497 O\n0.620501 0.758999 0.379500 O\n0.120501 0.758997 0.879499 O\n0.879499 0.758994 0.120500 O\n0.379499 0.758995 0.620503 O\n0.879500 0.241002 0.120500 O\n0.379498 0.241003 0.620503 O\n0.361506 0.758995 0.120500 O\n0.861508 0.758993 0.620504 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Ba",
"Sr",
"Ni",
"W",
"O"
],
"chemical_system": "Ba-Ni-O-Sr-W",
"density": 7.017600193528353,
"density_atomic": 0.07500038364922117,
"volume": 266.66530258752465,
"volume_molar": 8.029479939950328,
"formula_full": "Ba2 Sr2 Ni2 W2 O12",
"formula_reduced": "BaSrNiWO6",
"formula_anonymous": "ABCDE6",
"energy": -155.44524103999998,
"energy_per_atom": -7.772262051999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -133.24324104,
"band_gap": 3.3716000000000004,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:34.325000Z",
"spacegroup": 216
}
]
}