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=formation_energy&page=12113",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formation_energy&page=12111",
"results": [
{
"id": "mp-1350272",
"created_at": "2022-09-04T14:46:22.955186Z",
"structure_string": "Ca6 Bi12 O24\n1.0\n3.498214 6.078031 0.000000\n-3.498214 6.078031 0.000000\n0.000000 0.076022 17.198096\nCa Bi O\n6 12 24\ndirect\n0.836097 0.836097 0.959210 Ca\n0.166576 0.166576 0.666481 Ca\n0.333921 0.333921 0.832544 Ca\n0.833261 0.833261 0.334613 Ca\n0.999970 0.999970 0.500115 Ca\n0.666833 0.666833 0.167345 Ca\n0.834522 0.333410 0.831916 Bi\n0.502750 0.502750 0.622860 Bi\n0.498435 0.498435 0.995178 Bi\n0.333410 0.834522 0.831916 Bi\n0.500469 0.999907 0.500289 Bi\n0.169325 0.169325 0.290837 Bi\n0.999907 0.500469 0.500289 Bi\n0.160198 0.668230 0.167760 Bi\n0.830463 0.830463 0.709940 Bi\n0.668230 0.160198 0.167760 Bi\n0.497413 0.497413 0.376188 Bi\n0.163429 0.163429 0.041357 Bi\n0.651741 0.194485 0.913653 O\n0.499410 0.499410 0.755927 O\n0.194485 0.651741 0.913653 O\n0.656830 0.656830 0.914060 O\n0.322220 0.857243 0.580366 O\n0.009295 0.009295 0.751521 O\n0.165802 0.165802 0.423812 O\n0.477210 0.010916 0.752653 O\n0.857243 0.322220 0.580366 O\n0.167197 0.167197 0.907548 O\n0.322699 0.322699 0.581477 O\n0.010916 0.477210 0.752653 O\n0.990252 0.523169 0.247599 O\n0.677022 0.677022 0.418481 O\n0.142616 0.678151 0.419669 O\n0.523169 0.990252 0.247599 O\n0.834251 0.834251 0.094042 O\n0.834149 0.834149 0.576173 O\n0.988969 0.988969 0.248008 O\n0.678151 0.142616 0.419669 O\n0.338322 0.338322 0.085528 O\n0.815985 0.344366 0.087408 O\n0.501917 0.501917 0.244191 O\n0.344366 0.815985 0.087408 O\n",
"nsites": 42,
"nelements": 3,
"elements": [
"Ca",
"Bi",
"O"
],
"chemical_system": "Bi-Ca-O",
"density": 7.11183193742109,
"density_atomic": 0.05742878677117101,
"volume": 731.3405412402653,
"volume_molar": 10.486275435341579,
"formula_full": "Ca6 Bi12 O24",
"formula_reduced": "Ca(BiO2)2",
"formula_anonymous": "AB2C4",
"energy": -264.84600385,
"energy_per_atom": -6.305857234523809,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -248.35800385,
"band_gap": 1.8102,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000568,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:29.966000Z",
"spacegroup": 8
},
{
"id": "mp-1208428",
"created_at": "2022-09-04T14:46:22.956624Z",
"structure_string": "Tb10 Ni4 Bi2\n1.0\n-3.856298 3.856298 6.811127\n3.856298 -3.856298 6.811127\n3.856298 3.856298 -6.811127\nTb Ni Bi\n10 4 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.000000 Tb\n0.789837 0.289837 0.812556 Tb\n0.210163 0.710163 0.187444 Tb\n0.477281 0.977281 0.187444 Tb\n0.289837 0.477281 0.500000 Tb\n0.022719 0.210163 0.500000 Tb\n0.522719 0.022719 0.812556 Tb\n0.710163 0.522719 0.500000 Tb\n0.977281 0.789837 0.500000 Tb\n0.133072 0.633072 0.766144 Ni\n0.866928 0.366928 0.233856 Ni\n0.633072 0.866928 0.500000 Ni\n0.366928 0.133072 0.500000 Ni\n0.250000 0.250000 0.000000 Bi\n0.750000 0.750000 0.000000 Bi\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tb",
"Ni",
"Bi"
],
"chemical_system": "Bi-Ni-Tb",
"density": 9.188872341300575,
"density_atomic": 0.039491155279905654,
"volume": 405.15401199572665,
"volume_molar": 15.249340560731214,
"formula_full": "Tb10 Ni4 Bi2",
"formula_reduced": "Tb5Ni2Bi",
"formula_anonymous": "AB2C5",
"energy": -84.40692007,
"energy_per_atom": -5.275432504375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -84.40692007,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.003214,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:29.435000Z",
"spacegroup": 140
},
{
"id": "mp-1028185",
"created_at": "2022-09-04T14:46:22.963193Z",
"structure_string": "Rb1 Ca1 Mg14\n1.0\n6.752123 0.000000 0.000000\n-3.376062 5.847509 0.000000\n-0.000000 0.000000 10.632111\nRb Ca Mg\n1 1 14\ndirect\n0.166667 0.333333 0.625000 Rb\n0.166667 0.333333 0.125000 Ca\n0.172047 0.836023 0.125000 Mg\n0.170663 0.835331 0.625000 Mg\n0.663977 0.327953 0.125000 Mg\n0.664669 0.329337 0.625000 Mg\n0.663977 0.836023 0.125000 Mg\n0.664669 0.835331 0.625000 Mg\n0.340947 0.159053 0.368692 Mg\n0.340947 0.159053 0.881308 Mg\n0.340947 0.681895 0.368692 Mg\n0.340947 0.681895 0.881308 Mg\n0.818105 0.159053 0.368692 Mg\n0.818105 0.159053 0.881308 Mg\n0.833333 0.666667 0.375397 Mg\n0.833333 0.666667 0.874603 Mg\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Rb",
"Ca",
"Mg"
],
"chemical_system": "Ca-Mg-Rb",
"density": 1.8426063639898917,
"density_atomic": 0.03811441309823708,
"volume": 419.7887019475069,
"volume_molar": 15.800166578659832,
"formula_full": "Rb1 Ca1 Mg14",
"formula_reduced": "RbCaMg14",
"formula_anonymous": "ABC14",
"energy": -23.35009301,
"energy_per_atom": -1.459380813125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.35009301,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:30.387000Z",
"spacegroup": 187
},
{
"id": "mp-1205824",
"created_at": "2022-09-04T14:46:22.969206Z",
"structure_string": "Sc1 Tl3 F6\n1.0\n-4.674357 -4.674357 0.000000\n-4.674357 0.000000 -4.674357\n0.000000 -4.674357 -4.674357\nSc Tl F\n1 3 6\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750000 0.750000 0.750000 Tl\n0.250000 0.250000 0.250000 Tl\n0.500000 0.500000 0.500000 Tl\n0.782620 0.782620 0.217380 F\n0.217380 0.217380 0.782620 F\n0.782620 0.217380 0.782620 F\n0.217380 0.782620 0.217380 F\n0.217380 0.782620 0.782620 F\n0.782620 0.217380 0.217380 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sc",
"Tl",
"F"
],
"chemical_system": "F-Sc-Tl",
"density": 6.276606464647449,
"density_atomic": 0.048955824560299045,
"volume": 204.2657863454627,
"volume_molar": 12.301173178244623,
"formula_full": "Sc1 Tl3 F6",
"formula_reduced": "ScTl3F6",
"formula_anonymous": "AB3C6",
"energy": -53.90474614,
"energy_per_atom": -5.390474614,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.13274614,
"band_gap": 3.3232,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.87e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:31.232000Z",
"spacegroup": 225
},
{
"id": "mp-556405",
"created_at": "2022-09-04T14:46:22.971270Z",
"structure_string": "La2 C2 N4 F2\n1.0\n1.949004 -4.388039 0.000000\n1.949004 4.388039 0.000000\n0.000000 0.000000 7.866349\nLa C N F\n2 2 4 2\ndirect\n0.222184 0.777816 0.250000 La\n0.777816 0.222184 0.750000 La\n0.500000 0.500000 0.500000 C\n0.500000 0.500000 0.000000 C\n0.632076 0.367924 0.052619 N\n0.367924 0.632076 0.552619 N\n0.632076 0.367924 0.447381 N\n0.367924 0.632076 0.947381 N\n0.081190 0.918810 0.750000 F\n0.918810 0.081190 0.250000 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"La",
"C",
"N",
"F"
],
"chemical_system": "C-F-La-N",
"density": 4.885396930044567,
"density_atomic": 0.07432134911430338,
"volume": 134.55084062885328,
"volume_molar": 8.102841016432814,
"formula_full": "La2 C2 N4 F2",
"formula_reduced": "LaCN2F",
"formula_anonymous": "ABCD2",
"energy": -84.72591711999999,
"energy_per_atom": -8.472591712,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -82.35791712,
"band_gap": 2.6827999999999994,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 3.94e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:31.362000Z",
"spacegroup": 63
},
{
"id": "mp-1174362",
"created_at": "2022-09-04T14:46:22.973701Z",
"structure_string": "Li6 Mn3 Co1 O10\n1.0\n1.451060 12.169543 0.000000\n-1.451060 12.169543 0.000000\n0.000000 0.216478 5.199467\nLi Mn Co O\n6 3 1 10\ndirect\n0.504347 0.504347 0.501969 Li\n0.106954 0.106954 0.281705 Li\n0.694641 0.694641 0.102771 Li\n0.293942 0.293942 0.898409 Li\n0.897530 0.897530 0.707594 Li\n0.200089 0.200089 0.606202 Li\n0.001539 0.001539 0.988046 Mn\n0.796267 0.796267 0.424375 Mn\n0.399199 0.399199 0.204692 Mn\n0.609573 0.609573 0.764426 Co\n0.455459 0.455459 0.852656 O\n0.047531 0.047531 0.689511 O\n0.645177 0.645177 0.458968 O\n0.257443 0.257443 0.269205 O\n0.852387 0.852387 0.087805 O\n0.541818 0.541818 0.135513 O\n0.147307 0.147307 0.944422 O\n0.754594 0.754594 0.719963 O\n0.345392 0.345392 0.550097 O\n0.948811 0.948811 0.311668 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 3.846672263853597,
"density_atomic": 0.1089134546556411,
"volume": 183.63204126832014,
"volume_molar": 5.5292900028197645,
"formula_full": "Li6 Mn3 Co1 O10",
"formula_reduced": "Li6Mn3CoO10",
"formula_anonymous": "AB3C6D10",
"energy": -135.68379414,
"energy_per_atom": -6.784189707,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -122.17179414,
"band_gap": 0.4249,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 14.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:32.436000Z",
"spacegroup": 8
},
{
"id": "mp-1233708",
"created_at": "2022-09-04T14:46:22.996218Z",
"structure_string": "La4 Mg1 Ga2 Fe2 O12\n1.0\n-6.042861 0.061283 -0.202778\n-0.197273 0.282689 -5.688343\n0.111758 -8.433085 0.433558\nLa Mg Ga Fe O\n4 1 2 2 12\ndirect\n0.375874 0.459296 0.797768 La\n0.921888 0.054891 0.730418 La\n0.557972 0.522917 0.227275 La\n0.047257 0.965479 0.243779 La\n0.724821 0.623744 0.605172 Mg\n0.982566 0.465184 0.038144 Ga\n0.483258 0.043829 0.457516 Ga\n0.116357 0.493852 0.463836 Fe\n0.514075 0.978809 0.999014 Fe\n0.557853 0.827483 0.771518 O\n0.030392 0.632629 0.692414 O\n0.448741 0.119878 0.237310 O\n0.964319 0.384929 0.255995 O\n0.641562 0.300799 0.578854 O\n0.162548 0.204450 0.936158 O\n0.261036 0.664353 0.053941 O\n0.755343 0.841530 0.441619 O\n0.309732 0.742669 0.404437 O\n0.798453 0.753469 0.077153 O\n0.701125 0.296073 0.954072 O\n0.204351 0.183262 0.550274 O\n",
"nsites": 21,
"nelements": 5,
"elements": [
"La",
"Mg",
"Ga",
"Fe",
"O"
],
"chemical_system": "Fe-Ga-La-Mg-O",
"density": 5.882915459153033,
"density_atomic": 0.07272161811518373,
"volume": 288.7724523227483,
"volume_molar": 8.281087407133235,
"formula_full": "La4 Mg1 Ga2 Fe2 O12",
"formula_reduced": "La4MgGa2(FeO6)2",
"formula_anonymous": "AB2C2D4E12",
"energy": -163.36121066,
"energy_per_atom": -7.77910526952381,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -150.60521066,
"band_gap": 2.5975,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.0026823,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:34.744000Z",
"spacegroup": 1
},
{
"id": "mp-1003314",
"created_at": "2022-09-04T14:46:22.998425Z",
"structure_string": "K1 Mn2 O4\n1.0\n3.052286 0.000000 0.000000\n-0.297217 5.153217 0.000000\n-0.146789 -1.731534 6.338800\nK Mn O\n1 2 4\ndirect\n0.500000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.475885 0.791066 0.844931 O\n0.033982 0.260546 0.836263 O\n0.966018 0.739454 0.163737 O\n0.524115 0.208934 0.155069 O\n",
"nsites": 7,
"nelements": 3,
"elements": [
"K",
"Mn",
"O"
],
"chemical_system": "K-Mn-O",
"density": 3.5469974939700717,
"density_atomic": 0.07020811860754897,
"volume": 99.7035690292282,
"volume_molar": 8.577556099548412,
"formula_full": "K1 Mn2 O4",
"formula_reduced": "KMn2O4",
"formula_anonymous": "AB2C4",
"energy": -53.00058505,
"energy_per_atom": -7.571512149999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -46.91658505,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0000567,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:34.522000Z",
"spacegroup": 2
},
{
"id": "mp-756113",
"created_at": "2022-09-04T14:46:23.000255Z",
"structure_string": "Li4 Fe4 F12\n1.0\n5.502934 0.000000 0.000000\n0.705732 6.544085 0.000000\n0.761051 0.724789 6.814319\nLi Fe F\n4 4 12\ndirect\n0.797659 0.694929 0.408927 Li\n0.699838 0.122623 0.767188 Li\n0.300162 0.877377 0.232812 Li\n0.202341 0.305071 0.591073 Li\n0.746335 0.598123 0.910710 Fe\n0.247473 0.794549 0.717715 Fe\n0.752527 0.205451 0.282285 Fe\n0.253665 0.401877 0.089290 Fe\n0.382294 0.692874 0.020350 F\n0.888509 0.871523 0.847891 F\n0.112847 0.481998 0.816029 F\n0.601401 0.640371 0.653871 F\n0.618715 0.930303 0.288348 F\n0.885165 0.240375 0.540266 F\n0.114835 0.759625 0.459734 F\n0.381285 0.069697 0.711652 F\n0.398599 0.359629 0.346129 F\n0.887153 0.518002 0.183971 F\n0.111491 0.128477 0.152109 F\n0.617706 0.307126 0.979650 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Li",
"Fe",
"F"
],
"chemical_system": "F-Fe-Li",
"density": 3.2421424092395217,
"density_atomic": 0.0815012555990803,
"volume": 245.39499242053014,
"volume_molar": 7.389015930777828,
"formula_full": "Li4 Fe4 F12",
"formula_reduced": "LiFeF3",
"formula_anonymous": "ABC3",
"energy": -120.00917198,
"energy_per_atom": -6.000458599,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -105.44117197999998,
"band_gap": 0.0010999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 16.0000894,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:31.636000Z",
"spacegroup": 2
},
{
"id": "mp-1074066",
"created_at": "2022-09-04T14:46:22.980066Z",
"structure_string": "Mg18 Si10\n1.0\n7.183485 0.000000 0.000000\n-3.544201 -6.260400 0.000000\n-2.993614 1.067705 -12.806968\nMg Si\n18 10\ndirect\n0.922331 0.343331 0.375549 Mg\n0.132616 0.776790 0.517260 Mg\n0.406720 0.115202 0.376305 Mg\n0.717055 0.978064 0.534410 Mg\n0.674123 0.622937 0.368906 Mg\n0.400871 0.454863 0.543032 Mg\n0.895309 0.101873 0.865587 Mg\n0.778389 0.294594 0.057049 Mg\n0.451126 0.875809 0.936450 Mg\n0.207523 0.030153 0.052397 Mg\n0.363266 0.236724 0.851763 Mg\n0.518442 0.559681 0.053580 Mg\n0.087500 0.419360 0.694018 Mg\n0.003647 0.700574 0.217934 Mg\n0.585174 0.200408 0.689867 Mg\n0.535374 0.915435 0.216496 Mg\n0.938787 0.579008 0.863239 Mg\n0.216360 0.369399 0.216888 Mg\n0.216349 0.843365 0.739414 Si\n0.138613 0.089203 0.636574 Si\n0.979148 0.016804 0.332479 Si\n0.865096 0.974354 0.129013 Si\n0.494665 0.780424 0.693935 Si\n0.583663 0.326264 0.210339 Si\n0.619632 0.669814 0.856799 Si\n0.177670 0.631734 0.061766 Si\n0.337219 0.696240 0.379845 Si\n0.753307 0.397592 0.529327 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.07108810470386,
"density_atomic": 0.048615463979224,
"volume": 575.9484268619941,
"volume_molar": 12.38729463236962,
"formula_full": "Mg18 Si10",
"formula_reduced": "Mg9Si5",
"formula_anonymous": "A5B9",
"energy": -82.75339878000001,
"energy_per_atom": -2.955478527857143,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -83.46339878,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017414,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:34.613000Z",
"spacegroup": 1
},
{
"id": "mp-20129",
"created_at": "2022-09-04T14:46:22.981091Z",
"structure_string": "Ba4 Tb4 O12\n1.0\n6.257410 0.000000 0.000000\n0.000000 6.323942 0.000000\n0.000000 0.000000 8.801637\nBa Tb O\n4 4 12\ndirect\n0.994901 0.011134 0.250000 Ba\n0.494901 0.488866 0.250000 Ba\n0.505099 0.511134 0.750000 Ba\n0.005099 0.988866 0.750000 Ba\n0.000000 0.500000 0.000000 Tb\n0.500000 0.000000 0.500000 Tb\n0.500000 0.000000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n0.755043 0.755072 0.547308 O\n0.255043 0.744928 0.952692 O\n0.744957 0.255072 0.452692 O\n0.244957 0.244928 0.047308 O\n0.244957 0.244928 0.452692 O\n0.744957 0.255072 0.047308 O\n0.255043 0.744928 0.547308 O\n0.755043 0.755072 0.952692 O\n0.503467 0.918990 0.250000 O\n0.003467 0.581010 0.250000 O\n0.996533 0.418990 0.750000 O\n0.496533 0.081010 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ba",
"Tb",
"O"
],
"chemical_system": "Ba-O-Tb",
"density": 6.565046223874112,
"density_atomic": 0.057422758612497564,
"volume": 348.29396015201496,
"volume_molar": 10.487376269466326,
"formula_full": "Ba4 Tb4 O12",
"formula_reduced": "BaTbO3",
"formula_anonymous": "ABC3",
"energy": -148.08929952,
"energy_per_atom": -7.404464976,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -139.84529952,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.0015935,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:33.721000Z",
"spacegroup": 62
},
{
"id": "mp-1224230",
"created_at": "2022-09-04T14:46:22.982303Z",
"structure_string": "Hf1 W2\n1.0\n-1.618201 -1.678340 1.678340\n-1.618201 1.678340 -1.678340\n1.618201 -4.879717 -4.879717\nHf W\n1 2\ndirect\n0.000000 0.000000 0.000000 Hf\n0.673282 0.673282 0.346563 W\n0.326718 0.326718 0.653437 W\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Hf",
"W"
],
"chemical_system": "Hf-W",
"density": 17.10841992524264,
"density_atomic": 0.05659189245469611,
"volume": 53.011127033816905,
"volume_molar": 10.641348961462889,
"formula_full": "Hf1 W2",
"formula_reduced": "HfW2",
"formula_anonymous": "AB2",
"energy": -35.58483054,
"energy_per_atom": -11.86161018,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.58483054,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017474,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:31.044000Z",
"spacegroup": 69
}
]
}