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=52",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=50",
"results": [
{
"id": "mp-1516632",
"created_at": "2022-09-04T14:44:24.927543Z",
"structure_string": "Ba4 Na4 Sm4 W4 O24\n1.0\n8.413365 0.000000 0.000000\n0.000000 8.463072 0.000000\n0.000000 0.000000 8.483499\nBa Na Sm W O\n4 4 4 4 24\ndirect\n-0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n-0.000000 0.000000 0.500000 Ba\n-0.000000 0.500000 0.500000 Na\n0.500000 0.000000 0.500000 Na\n0.500000 0.000000 -0.000000 Na\n-0.000000 0.500000 -0.000000 Na\n0.750000 0.750000 0.750000 Sm\n0.250000 0.250000 0.750000 Sm\n0.250000 0.750000 0.250000 Sm\n0.750000 0.250000 0.250000 Sm\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\n0.020629 0.218307 0.271474 O\n0.979371 0.781693 0.271474 O\n0.979371 0.218307 0.728526 O\n0.020629 0.781693 0.728526 O\n0.270885 0.022163 0.216179 O\n0.270885 0.977837 0.783821 O\n0.729115 0.977837 0.216179 O\n0.729115 0.022163 0.783821 O\n0.220729 0.280284 0.022100 O\n0.779271 0.280284 0.977900 O\n0.220729 0.719716 0.977900 O\n0.779271 0.719716 0.022100 O\n0.479371 0.281693 0.228526 O\n0.520629 0.718307 0.228526 O\n0.520629 0.281693 0.771474 O\n0.479371 0.718307 0.771474 O\n0.229115 0.477837 0.283821 O\n0.229115 0.522163 0.716179 O\n0.770885 0.522163 0.283821 O\n0.770885 0.477837 0.716179 O\n0.279271 0.219716 0.477899 O\n0.720729 0.219716 0.522100 O\n0.279271 0.780284 0.522100 O\n0.720729 0.780284 0.477899 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"Ba",
"Na",
"Sm",
"W",
"O"
],
"chemical_system": "Ba-Na-O-Sm-W",
"density": 6.493306409957523,
"density_atomic": 0.06621970050179578,
"volume": 604.0498476569712,
"volume_molar": 9.094183021617093,
"formula_full": "Ba4 Na4 Sm4 W4 O24",
"formula_reduced": "BaNaSmWO6",
"formula_anonymous": "ABCDE6",
"energy": -317.66896646000004,
"energy_per_atom": -7.941724161500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -283.42896646,
"band_gap": 2.92,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:43.772000Z",
"spacegroup": 48
},
{
"id": "mp-1520699",
"created_at": "2022-09-04T14:42:23.372917Z",
"structure_string": "K1 Sr1 Gd1 Mn1 O6\n1.0\n0.000000 -4.148482 -4.148482\n4.148482 0.000000 -4.148482\n4.148482 -4.148482 0.000000\nK Sr Gd Mn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Gd\n0.500000 0.500000 0.500000 Mn\n0.729350 0.270650 0.270650 O\n0.270650 0.729350 0.729350 O\n0.729350 0.270650 0.729350 O\n0.270650 0.729350 0.270650 O\n0.729350 0.729350 0.270650 O\n0.270650 0.270650 0.729350 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"Sr",
"Gd",
"Mn",
"O"
],
"chemical_system": "Gd-K-Mn-O-Sr",
"density": 5.057590007825098,
"density_atomic": 0.07003294252377669,
"volume": 142.78994484067164,
"volume_molar": 8.599011469431604,
"formula_full": "K1 Sr1 Gd1 Mn1 O6",
"formula_reduced": "KSrGdMnO6",
"formula_anonymous": "ABCDE6",
"energy": -79.68684130000001,
"energy_per_atom": -7.9686841300000015,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -73.8968413,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9999995,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:44.683000Z",
"spacegroup": 216
},
{
"id": "mp-1517552",
"created_at": "2022-09-04T14:45:13.967350Z",
"structure_string": "Sr1 Eu1 Hf1 Sb1 O6\n1.0\n-0.000000 -4.183652 -4.183652\n4.183652 -0.000000 -4.183652\n4.183652 -4.183652 -0.000000\nSr Eu Hf Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Eu\n0.000000 0.000000 0.000000 Hf\n0.500000 0.500000 0.500000 Sb\n0.753751 0.246249 0.246249 O\n0.246249 0.753751 0.753751 O\n0.753751 0.246249 0.753751 O\n0.246249 0.753751 0.246249 O\n0.753751 0.753751 0.246249 O\n0.246249 0.246249 0.753751 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Eu",
"Hf",
"Sb",
"O"
],
"chemical_system": "Eu-Hf-O-Sb-Sr",
"density": 7.20931053995134,
"density_atomic": 0.06828154625689813,
"volume": 146.45245382078255,
"volume_molar": 8.819572915561524,
"formula_full": "Sr1 Eu1 Hf1 Sb1 O6",
"formula_reduced": "SrEuHfSbO6",
"formula_anonymous": "ABCDE6",
"energy": -85.55382538,
"energy_per_atom": -8.555382538,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -81.43182538000002,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.6007213,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:54.417000Z",
"spacegroup": 216
},
{
"id": "mp-1218113",
"created_at": "2022-09-04T14:42:24.866670Z",
"structure_string": "Sr2 Pr2 Ni2 Ru2 O12\n1.0\n5.655540 0.000000 0.000000\n0.000000 5.577539 0.000000\n0.000000 5.567343 7.899062\nSr Pr Ni Ru O\n2 2 2 2 12\ndirect\n0.215842 0.245130 0.249509 Sr\n0.784158 0.245130 0.749509 Sr\n0.302322 0.761313 0.751650 Pr\n0.697678 0.761313 0.251650 Pr\n0.756098 0.500682 0.000800 Ni\n0.243902 0.500682 0.500800 Ni\n0.753317 0.000415 0.499716 Ru\n0.246683 0.000415 0.999716 Ru\n0.762281 0.332815 0.256041 O\n0.237719 0.332815 0.756041 O\n0.728667 0.689329 0.744423 O\n0.271333 0.689329 0.244423 O\n0.038457 0.151675 0.544331 O\n0.961543 0.151675 0.044331 O\n0.475962 0.825708 0.460481 O\n0.524038 0.825708 0.960481 O\n0.949813 0.757080 0.455339 O\n0.050187 0.757080 0.955339 O\n0.535292 0.235853 0.537711 O\n0.464708 0.235853 0.037711 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Sr",
"Pr",
"Ni",
"Ru",
"O"
],
"chemical_system": "Ni-O-Pr-Ru-Sr",
"density": 6.454908511099111,
"density_atomic": 0.08026713816390313,
"volume": 249.16797156964273,
"volume_molar": 7.502622988380333,
"formula_full": "Sr2 Pr2 Ni2 Ru2 O12",
"formula_reduced": "SrPrNiRuO6",
"formula_anonymous": "ABCDE6",
"energy": -150.22970403,
"energy_per_atom": -7.511485201499999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -136.90370403,
"band_gap": 0.0030000000000001,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 10.0016268,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:48.731000Z",
"spacegroup": 7
},
{
"id": "mp-1523044",
"created_at": "2022-09-04T14:44:20.971634Z",
"structure_string": "Sr1 Ce1 Pr1 Co1 O6\n1.0\n-0.000000 -4.066094 -4.066094\n4.066094 0.000000 -4.066094\n4.066094 -4.066094 0.000000\nSr Ce Pr Co O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Ce\n0.750000 0.750000 0.750000 Pr\n0.500000 0.500000 0.500000 Co\n0.732518 0.267482 0.267482 O\n0.267482 0.732518 0.732518 O\n0.732518 0.267482 0.732518 O\n0.267482 0.732518 0.267482 O\n0.732518 0.732518 0.267482 O\n0.267482 0.267482 0.732518 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Ce",
"Pr",
"Co",
"O"
],
"chemical_system": "Ce-Co-O-Pr-Sr",
"density": 6.466425883015409,
"density_atomic": 0.07437684653860324,
"volume": 134.4504434563487,
"volume_molar": 8.096794957385528,
"formula_full": "Sr1 Ce1 Pr1 Co1 O6",
"formula_reduced": "SrCePrCoO6",
"formula_anonymous": "ABCDE6",
"energy": -78.04974761000001,
"energy_per_atom": -7.804974761000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -72.28974761,
"band_gap": 1.8113,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.200000Z",
"spacegroup": 216
},
{
"id": "mp-1521619",
"created_at": "2022-09-04T14:43:12.333802Z",
"structure_string": "Ca1 Eu1 Nb1 Fe1 O6\n1.0\n0.000000 -3.998983 -3.998983\n3.998983 -0.000000 -3.998983\n3.998983 -3.998983 0.000000\nCa Eu Nb Fe O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ca\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 Nb\n0.000000 -0.000000 -0.000000 Fe\n0.750140 0.249860 0.249860 O\n0.249860 0.750140 0.750140 O\n0.750140 0.249860 0.750140 O\n0.249860 0.750140 0.249860 O\n0.750140 0.750140 0.249860 O\n0.249860 0.249860 0.750140 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ca",
"Eu",
"Nb",
"Fe",
"O"
],
"chemical_system": "Ca-Eu-Fe-Nb-O",
"density": 5.670781269883202,
"density_atomic": 0.07818462015803068,
"volume": 127.90239282083225,
"volume_molar": 7.702462131078652,
"formula_full": "Ca1 Eu1 Nb1 Fe1 O6",
"formula_reduced": "CaEuNbFeO6",
"formula_anonymous": "ABCDE6",
"energy": -89.15744286999998,
"energy_per_atom": -8.915744286999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -82.77944287,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 11.7352481,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:07.282000Z",
"spacegroup": 216
},
{
"id": "mp-1521864",
"created_at": "2022-09-04T14:40:15.877992Z",
"structure_string": "Na1 Ca1 Tb1 Fe1 O6\n1.0\n0.000000 -4.043415 -4.043415\n4.043415 0.000000 -4.043415\n4.043415 -4.043415 0.000000\nNa Ca Tb Fe O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Fe\n0.770915 0.229085 0.229085 O\n0.229085 0.770915 0.770915 O\n0.770915 0.229085 0.770915 O\n0.229085 0.770915 0.229085 O\n0.770915 0.770915 0.229085 O\n0.229085 0.229085 0.770915 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Na",
"Ca",
"Tb",
"Fe",
"O"
],
"chemical_system": "Ca-Fe-Na-O-Tb",
"density": 4.695194082201167,
"density_atomic": 0.07563539001899341,
"volume": 132.21324035598704,
"volume_molar": 7.962067437594665,
"formula_full": "Na1 Ca1 Tb1 Fe1 O6",
"formula_reduced": "NaCaTbFeO6",
"formula_anonymous": "ABCDE6",
"energy": -67.98340388,
"energy_per_atom": -6.798340388,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -61.60540388,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9969609,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:57.172000Z",
"spacegroup": 216
},
{
"id": "mp-1519937",
"created_at": "2022-09-04T14:40:31.508120Z",
"structure_string": "Sr4 Nd4 Eu4 Nb4 O24\n1.0\n8.518851 0.000000 0.000000\n0.000000 8.487829 0.000000\n0.000000 0.000000 8.495129\nSr Nd Eu Nb O\n4 4 4 4 24\ndirect\n-0.000000 0.500000 0.500000 Sr\n0.500000 -0.000000 0.500000 Sr\n0.500000 -0.000000 -0.000000 Sr\n-0.000000 0.500000 0.000000 Sr\n0.250000 0.250000 0.250000 Nd\n0.750000 0.750000 0.250000 Nd\n0.750000 0.250000 0.750000 Nd\n0.250000 0.750000 0.750000 Nd\n0.500000 0.500000 0.000000 Eu\n-0.000000 -0.000000 0.500000 Eu\n-0.000000 -0.000000 -0.000000 Eu\n0.500000 0.500000 0.500000 Eu\n0.750000 0.750000 0.750000 Nb\n0.250000 0.250000 0.750000 Nb\n0.250000 0.750000 0.250000 Nb\n0.750000 0.250000 0.250000 Nb\n0.980680 0.200168 0.290576 O\n0.019320 0.799832 0.290576 O\n0.019320 0.200168 0.709424 O\n0.980680 0.799832 0.709424 O\n0.289456 0.980324 0.201305 O\n0.289456 0.019676 0.798695 O\n0.710544 0.019676 0.201305 O\n0.710544 0.980324 0.798695 O\n0.201455 0.289577 0.980496 O\n0.798545 0.289577 0.019504 O\n0.201455 0.710423 0.019504 O\n0.798545 0.710423 0.980496 O\n0.519320 0.299832 0.209424 O\n0.480680 0.700168 0.209424 O\n0.480680 0.299832 0.790576 O\n0.519320 0.700168 0.790576 O\n0.210544 0.519676 0.298695 O\n0.210544 0.480324 0.701305 O\n0.789456 0.480324 0.298695 O\n0.789456 0.519676 0.701305 O\n0.298545 0.210423 0.519504 O\n0.701455 0.210423 0.480496 O\n0.298545 0.789577 0.480496 O\n0.701455 0.789577 0.519504 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"Sr",
"Nd",
"Eu",
"Nb",
"O"
],
"chemical_system": "Eu-Nb-Nd-O-Sr",
"density": 6.193133962428341,
"density_atomic": 0.06511969676147354,
"volume": 614.2534745902719,
"volume_molar": 9.247802215754252,
"formula_full": "Sr4 Nd4 Eu4 Nb4 O24",
"formula_reduced": "SrNdEuNbO6",
"formula_anonymous": "ABCDE6",
"energy": -359.48920097,
"energy_per_atom": -8.98723002425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -343.00120097,
"band_gap": 0.0962999999999993,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 27.9790709,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:03.594000Z",
"spacegroup": 48
},
{
"id": "mp-1520444",
"created_at": "2022-09-04T14:40:31.623577Z",
"structure_string": "Ba1 Pr1 Eu1 Fe1 O6\n1.0\n0.000000 -4.158801 -4.158801\n4.158801 0.000000 -4.158801\n4.158801 -4.158801 -0.000000\nBa Pr Eu Fe O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Pr\n0.000000 -0.000000 -0.000000 Eu\n0.500000 0.500000 0.500000 Fe\n0.735028 0.264972 0.264972 O\n0.264972 0.735028 0.735028 O\n0.735028 0.264972 0.735028 O\n0.264972 0.735028 0.264972 O\n0.735028 0.735028 0.264972 O\n0.264972 0.264972 0.735028 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Pr",
"Eu",
"Fe",
"O"
],
"chemical_system": "Ba-Eu-Fe-O-Pr",
"density": 6.71842621612169,
"density_atomic": 0.06951292848858232,
"volume": 143.8581313926736,
"volume_molar": 8.663339167172552,
"formula_full": "Ba1 Pr1 Eu1 Fe1 O6",
"formula_reduced": "BaPrEuFeO6",
"formula_anonymous": "ABCDE6",
"energy": -81.5114481,
"energy_per_atom": -8.15114481,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -75.1334481,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.9999999,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:05.753000Z",
"spacegroup": 216
},
{
"id": "mp-1518903",
"created_at": "2022-09-04T14:42:24.844722Z",
"structure_string": "Ba1 Sr1 Ce1 Bi1 O6\n1.0\n0.000000 -4.427645 -4.427645\n4.427645 -0.000000 -4.427645\n4.427645 -4.427645 0.000000\nBa Sr Ce Bi O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Sr\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.000000 Bi\n0.749405 0.250595 0.250595 O\n0.250595 0.749405 0.749405 O\n0.749405 0.250595 0.749405 O\n0.250595 0.749405 0.250595 O\n0.749405 0.749405 0.250595 O\n0.250595 0.250595 0.749405 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Sr",
"Ce",
"Bi",
"O"
],
"chemical_system": "Ba-Bi-Ce-O-Sr",
"density": 6.409163105353094,
"density_atomic": 0.05760386530408089,
"volume": 173.59946155022274,
"volume_molar": 10.45440393315649,
"formula_full": "Ba1 Sr1 Ce1 Bi1 O6",
"formula_reduced": "BaSrCeBiO6",
"formula_anonymous": "ABCDE6",
"energy": -71.26773786,
"energy_per_atom": -7.126773785999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -67.14573786,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.2750267,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:45.927000Z",
"spacegroup": 216
},
{
"id": "mp-1520401",
"created_at": "2022-09-04T14:43:13.358527Z",
"structure_string": "Ba1 Eu1 Dy1 Sb1 O6\n1.0\n0.000000 -4.226996 -4.226996\n4.226996 -0.000000 -4.226996\n4.226996 -4.226996 0.000000\nBa Eu Dy Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Eu\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 Sb\n0.737105 0.262895 0.262895 O\n0.262895 0.737105 0.737105 O\n0.737105 0.262895 0.737105 O\n0.262895 0.737105 0.262895 O\n0.737105 0.737105 0.262895 O\n0.262895 0.262895 0.737105 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Eu",
"Dy",
"Sb",
"O"
],
"chemical_system": "Ba-Dy-Eu-O-Sb",
"density": 7.3604593602970985,
"density_atomic": 0.06620251582081672,
"volume": 151.05166134570976,
"volume_molar": 9.096543666557151,
"formula_full": "Ba1 Eu1 Dy1 Sb1 O6",
"formula_reduced": "BaEuDySbO6",
"formula_anonymous": "ABCDE6",
"energy": -81.02674687000001,
"energy_per_atom": -8.102674687,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -76.90474687,
"band_gap": 0.4085999999999998,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 7.0000002,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:11.202000Z",
"spacegroup": 216
},
{
"id": "mp-1227855",
"created_at": "2022-09-04T14:45:35.115409Z",
"structure_string": "Ba1 La1 Mn1 Ru1 O6\n1.0\n0.000000 4.061397 4.061397\n4.061397 0.000000 4.061397\n4.061397 4.061397 0.000000\nBa La Mn Ru O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Ru\n0.743562 0.256438 0.256438 O\n0.256438 0.743562 0.743562 O\n0.743562 0.256438 0.743562 O\n0.256438 0.743562 0.256438 O\n0.256438 0.256438 0.743562 O\n0.743562 0.743562 0.256438 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"La",
"Mn",
"Ru",
"O"
],
"chemical_system": "Ba-La-Mn-O-Ru",
"density": 6.546686111438254,
"density_atomic": 0.07463519524803124,
"volume": 133.98504508184809,
"volume_molar": 8.06876801217835,
"formula_full": "Ba1 La1 Mn1 Ru1 O6",
"formula_reduced": "BaLaMnRuO6",
"formula_anonymous": "ABCDE6",
"energy": -79.97878093,
"energy_per_atom": -7.997878093,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -74.18878093,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:05.797000Z",
"spacegroup": 216
}
]
}