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_reduced&page=10139",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_reduced&page=10137",
"results": [
{
"id": "mp-729",
"created_at": "2022-09-04T14:45:32.436902Z",
"structure_string": "Cr6 Si2\n1.0\n4.518832 0.000000 0.000000\n0.000000 4.518832 0.000000\n0.000000 0.000000 4.518832\nCr Si\n6 2\ndirect\n0.000000 0.500000 0.250000 Cr\n0.000000 0.500000 0.750000 Cr\n0.500000 0.750000 0.000000 Cr\n0.500000 0.250000 0.000000 Cr\n0.750000 0.000000 0.500000 Cr\n0.250000 0.000000 0.500000 Cr\n0.500000 0.500000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Cr",
"Si"
],
"chemical_system": "Cr-Si",
"density": 6.625100709326577,
"density_atomic": 0.0866984634087592,
"volume": 92.27383837568401,
"volume_molar": 6.946075539548236,
"formula_full": "Cr6 Si2",
"formula_reduced": "Cr3Si",
"formula_anonymous": "AB3",
"energy": -71.35214825,
"energy_per_atom": -8.91901853125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -71.49414825,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0010025,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:06.564000Z",
"spacegroup": 223
},
{
"id": "mp-27840",
"created_at": "2022-09-04T14:48:12.532758Z",
"structure_string": "Cr3 Se4\n1.0\n1.839794 6.669815 0.000000\n-1.839794 6.669815 0.000000\n0.000000 2.940648 5.723338\nCr Se\n3 4\ndirect\n0.500000 0.500000 0.500000 Cr\n0.761685 0.761685 0.217740 Cr\n0.238315 0.238315 0.782260 Cr\n0.134260 0.134260 0.522731 Se\n0.865740 0.865740 0.477269 Se\n0.622803 0.622803 0.048954 Se\n0.377197 0.377197 0.951046 Se\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Cr",
"Se"
],
"chemical_system": "Cr-Se",
"density": 5.577899781876997,
"density_atomic": 0.049835137803882074,
"volume": 140.4631412387649,
"volume_molar": 12.084125830451473,
"formula_full": "Cr3 Se4",
"formula_reduced": "Cr3Se4",
"formula_anonymous": "A3B4",
"energy": -48.30986391,
"energy_per_atom": -6.901409129999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -46.42186391,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.9945388,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:35.789000Z",
"spacegroup": 12
},
{
"id": "mp-1048591",
"created_at": "2022-09-04T14:39:07.773375Z",
"structure_string": "Cr6 Se4 Cl2 O16\n1.0\n6.414886 0.000000 0.000000\n0.000000 7.917739 0.000000\n0.000000 0.116512 10.058548\nCr Se Cl O\n6 4 2 16\ndirect\n0.500000 0.500000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.250000 0.698324 0.750433 Cr\n0.750000 0.301676 0.249567 Cr\n0.000000 0.500000 0.500000 Cr\n0.250000 0.857990 0.045106 Se\n0.750000 0.142010 0.954894 Se\n0.250000 0.854253 0.443099 Se\n0.750000 0.145747 0.556901 Se\n0.750000 0.606953 0.831303 Cl\n0.250000 0.393047 0.168697 Cl\n0.750000 0.457721 0.110924 O\n0.750000 0.112791 0.126485 O\n0.250000 0.884974 0.611674 O\n0.464246 0.730330 0.073374 O\n0.533040 0.276647 0.574771 O\n0.966960 0.276647 0.574771 O\n0.250000 0.542279 0.889076 O\n0.035754 0.730330 0.073374 O\n0.033040 0.723353 0.425229 O\n0.964246 0.269670 0.926626 O\n0.750000 0.460951 0.396658 O\n0.250000 0.539049 0.603342 O\n0.535754 0.269670 0.926626 O\n0.466960 0.723353 0.425229 O\n0.250000 0.887209 0.873515 O\n0.750000 0.115026 0.388326 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Cr",
"Se",
"Cl",
"O"
],
"chemical_system": "Cl-Cr-O-Se",
"density": 3.103105324639137,
"density_atomic": 0.054806568864897535,
"volume": 510.8876651085782,
"volume_molar": 10.987990827969995,
"formula_full": "Cr6 Se4 Cl2 O16",
"formula_reduced": "Cr3Se2ClO8",
"formula_anonymous": "AB2C3D8",
"energy": -199.05950877,
"energy_per_atom": -7.109268170357143,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -174.84550877,
"band_gap": 0.5232,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 18.0002778,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:30.572000Z",
"spacegroup": 11
},
{
"id": "mp-984712",
"created_at": "2022-09-04T14:40:30.643239Z",
"structure_string": "Cr3 Se1\n1.0\n-1.736492 1.736492 4.120979\n1.736492 -1.736492 4.120979\n1.736492 1.736492 -4.120979\nCr Se\n3 1\ndirect\n0.750000 0.250000 0.500000 Cr\n0.250000 0.750000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Se"
],
"chemical_system": "Cr-Se",
"density": 7.849020040908926,
"density_atomic": 0.08047371022603578,
"volume": 49.705673924623824,
"volume_molar": 7.483364123618658,
"formula_full": "Cr3 Se1",
"formula_reduced": "Cr3Se",
"formula_anonymous": "AB3",
"energy": -31.48673892,
"energy_per_atom": -7.87168473,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -31.01473892,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0045651,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:58.278000Z",
"spacegroup": 139
},
{
"id": "mp-773143",
"created_at": "2022-09-04T14:39:20.645468Z",
"structure_string": "Cr3 Sb1 P6 O24\n1.0\n7.701237 -4.293215 0.000000\n7.701237 4.293215 0.000000\n5.307895 0.000000 7.040383\nCr Sb P O\n3 1 6 24\ndirect\n0.856871 0.856871 0.856871 Cr\n0.643860 0.643860 0.643860 Cr\n0.357908 0.357908 0.357908 Cr\n0.142900 0.142900 0.142900 Sb\n0.250868 0.539259 0.963865 P\n0.963865 0.250868 0.539259 P\n0.539259 0.963865 0.250868 P\n0.468082 0.034047 0.747387 P\n0.034047 0.747387 0.468082 P\n0.747387 0.468082 0.034047 P\n0.720187 0.493596 0.862820 O\n0.493596 0.862820 0.720187 O\n0.077401 0.719949 0.936370 O\n0.862820 0.720187 0.493596 O\n0.424048 0.565922 0.782029 O\n0.228282 0.365501 0.981265 O\n0.936370 0.077401 0.719949 O\n0.782029 0.424048 0.565922 O\n0.565922 0.782029 0.424048 O\n0.634633 0.008127 0.781733 O\n0.280887 0.056744 0.922897 O\n0.008127 0.781733 0.634633 O\n0.981265 0.228282 0.365501 O\n0.719949 0.936370 0.077401 O\n0.365501 0.981265 0.228282 O\n0.439805 0.215217 0.575203 O\n0.215217 0.575203 0.439805 O\n0.056744 0.922897 0.280887 O\n0.781733 0.634633 0.008127 O\n0.575203 0.439805 0.215216 O\n0.137306 0.277969 0.507063 O\n0.922897 0.280887 0.056744 O\n0.507063 0.137306 0.277969 O\n0.277969 0.507063 0.137306 O\n",
"nsites": 34,
"nelements": 4,
"elements": [
"Cr",
"Sb",
"P",
"O"
],
"chemical_system": "Cr-O-P-Sb",
"density": 3.0231422443224663,
"density_atomic": 0.07303138031532415,
"volume": 465.5532985026409,
"volume_molar": 8.245963220191769,
"formula_full": "Cr3 Sb1 P6 O24",
"formula_reduced": "Cr3Sb(PO4)6",
"formula_anonymous": "AB3C6D24",
"energy": -263.74112457,
"energy_per_atom": -7.757091899117647,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -241.25612457,
"band_gap": 0.0055,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.000007,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:32.464000Z",
"spacegroup": 146
},
{
"id": "mp-754056",
"created_at": "2022-09-04T14:42:41.401757Z",
"structure_string": "Cr3 Sb1 P4 O16\n1.0\n4.898715 -0.045293 0.000006\n-0.089463 10.219201 -0.000080\n0.000008 -0.000042 5.883497\nCr Sb P O\n3 1 4 16\ndirect\n0.447446 0.224096 0.750168 Cr\n0.551597 0.781789 0.249974 Cr\n0.953495 0.264324 0.249948 Cr\n0.040645 0.724851 0.750009 Sb\n0.126769 0.592796 0.249996 P\n0.392511 0.090713 0.250025 P\n0.591485 0.923179 0.749999 P\n0.893178 0.390485 0.749987 P\n0.146356 0.444834 0.249991 O\n0.298376 0.661796 0.050103 O\n0.298347 0.661792 0.449926 O\n0.201847 0.373933 0.749952 O\n0.281981 0.901988 0.749959 O\n0.244461 0.165925 0.047184 O\n0.244484 0.165926 0.452918 O\n0.322276 0.944192 0.249976 O\n0.669565 0.067680 0.749985 O\n0.727524 0.851587 0.540867 O\n0.727500 0.851590 0.959118 O\n0.701823 0.112611 0.249991 O\n0.832902 0.640188 0.249978 O\n0.746457 0.315691 0.544000 O\n0.746532 0.315719 0.955971 O\n0.812440 0.532315 0.749977 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cr",
"Sb",
"P",
"O"
],
"chemical_system": "Cr-O-P-Sb",
"density": 3.7079484900293194,
"density_atomic": 0.08149139357916059,
"volume": 294.50962789937375,
"volume_molar": 7.389910143271884,
"formula_full": "Cr3 Sb1 P4 O16",
"formula_reduced": "Cr3Sb(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy": -192.97819638000004,
"energy_per_atom": -8.040758182500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -175.98919638,
"band_gap": 0.6692,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.0020587,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:56.412000Z",
"spacegroup": 6
},
{
"id": "mp-773170",
"created_at": "2022-09-04T14:46:17.169933Z",
"structure_string": "Cr6 Sb2 O16\n1.0\n5.124935 2.991518 0.000000\n-5.124935 2.991518 0.000000\n0.000000 0.227455 9.274876\nCr Sb O\n6 2 16\ndirect\n0.830318 0.659395 0.787755 Cr\n0.333074 0.167723 0.796042 Cr\n0.828905 0.171776 0.780638 Cr\n0.171776 0.828905 0.280638 Cr\n0.659395 0.830318 0.287755 Cr\n0.167723 0.333074 0.296042 Cr\n0.666361 0.340343 0.509132 Sb\n0.340343 0.666361 0.009132 Sb\n0.833798 0.668605 0.400711 O\n0.514123 0.470244 0.665291 O\n0.666847 0.321373 0.893299 O\n0.998537 0.009137 0.700763 O\n0.009137 0.998537 0.200763 O\n0.338099 0.174878 0.395477 O\n0.956218 0.472891 0.657088 O\n0.519562 0.045736 0.662180 O\n0.175871 0.836371 0.893762 O\n0.836371 0.175871 0.393762 O\n0.472891 0.956218 0.157088 O\n0.045736 0.519562 0.162180 O\n0.321373 0.666847 0.393299 O\n0.668605 0.833798 0.900711 O\n0.470244 0.514123 0.165291 O\n0.174878 0.338099 0.895477 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cr",
"Sb",
"O"
],
"chemical_system": "Cr-O-Sb",
"density": 4.738191122236981,
"density_atomic": 0.08439042073355475,
"volume": 284.3924676685168,
"volume_molar": 7.136047797431488,
"formula_full": "Cr6 Sb2 O16",
"formula_reduced": "Cr3SbO8",
"formula_anonymous": "AB3C8",
"energy": -192.88549009,
"energy_per_atom": -8.036895420416666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -169.89949009,
"band_gap": 0.0352000000000001,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 13.9999292,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:34.029000Z",
"spacegroup": 9
},
{
"id": "mp-1226373",
"created_at": "2022-09-04T14:41:49.262454Z",
"structure_string": "Cr12 Sb4 As8\n1.0\n3.697590 0.000000 0.000000\n0.000000 8.696758 0.000000\n0.000000 2.949097 12.969180\nCr Sb As\n12 4 8\ndirect\n0.000000 0.027513 0.735239 Cr\n0.000000 0.354687 0.075711 Cr\n0.000000 0.694766 0.400772 Cr\n0.000000 0.826312 0.589563 Cr\n0.000000 0.147730 0.929230 Cr\n0.000000 0.494011 0.257850 Cr\n0.500000 0.294801 0.597768 Cr\n0.500000 0.638762 0.932448 Cr\n0.500000 0.963695 0.264010 Cr\n0.500000 0.531698 0.733641 Cr\n0.500000 0.850554 0.081247 Cr\n0.500000 0.182884 0.415247 Cr\n0.000000 0.850312 0.931653 Sb\n0.000000 0.182694 0.268130 Sb\n0.000000 0.516688 0.592677 Sb\n0.000000 0.458477 0.874825 Sb\n0.000000 0.795502 0.212186 As\n0.000000 0.128463 0.546240 As\n0.500000 0.146031 0.067887 As\n0.500000 0.482203 0.399196 As\n0.500000 0.819726 0.731561 As\n0.500000 0.537272 0.121350 As\n0.500000 0.870400 0.453648 As\n0.500000 0.204820 0.787920 As\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cr",
"Sb",
"As"
],
"chemical_system": "As-Cr-Sb",
"density": 6.8100373731779325,
"density_atomic": 0.05754698630301681,
"volume": 417.0505102322246,
"volume_molar": 10.464736986034488,
"formula_full": "Cr12 Sb4 As8",
"formula_reduced": "Cr3SbAs2",
"formula_anonymous": "AB2C3",
"energy": -171.64806793,
"energy_per_atom": -7.1520028304166665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -170.88006793,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 30.3541487,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:28.666000Z",
"spacegroup": 6
},
{
"id": "mp-777918",
"created_at": "2022-09-04T14:42:08.995004Z",
"structure_string": "Cr3 Sb5 O16\n1.0\n3.082351 5.324151 0.000000\n-3.082351 5.324151 0.000000\n0.000000 0.029853 9.904561\nCr Sb O\n3 5 16\ndirect\n0.342700 0.831485 0.804059 Cr\n0.831485 0.342700 0.804059 Cr\n0.166247 0.166247 0.274169 Cr\n0.653039 0.653039 0.537139 Sb\n0.326483 0.326483 0.003908 Sb\n0.832736 0.832736 0.799881 Sb\n0.166348 0.672540 0.272931 Sb\n0.672540 0.166348 0.272931 Sb\n0.313129 0.839674 0.374338 O\n0.520406 0.520406 0.690895 O\n0.671548 0.671548 0.904384 O\n0.000001 0.000001 0.713684 O\n0.002513 0.002513 0.166007 O\n0.839674 0.313129 0.374338 O\n0.521928 0.960212 0.682761 O\n0.960212 0.521928 0.682761 O\n0.166918 0.166918 0.909149 O\n0.836782 0.836782 0.370717 O\n0.050264 0.480102 0.152037 O\n0.480102 0.050264 0.152037 O\n0.337153 0.337153 0.377065 O\n0.166552 0.661809 0.909640 O\n0.479561 0.479561 0.145773 O\n0.661809 0.166552 0.909640 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cr",
"Sb",
"O"
],
"chemical_system": "Cr-O-Sb",
"density": 5.214143913598156,
"density_atomic": 0.07382671742998552,
"volume": 325.0855629977142,
"volume_molar": 8.157129247567012,
"formula_full": "Cr3 Sb5 O16",
"formula_reduced": "Cr3Sb5O16",
"formula_anonymous": "A3B5C16",
"energy": -174.92230741,
"energy_per_atom": -7.288429475416667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -157.93330741,
"band_gap": 0.2157,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.9996934,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.861000Z",
"spacegroup": 8
},
{
"id": "mp-756097",
"created_at": "2022-09-04T14:46:39.920750Z",
"structure_string": "Cr3 Sb3 Te2 O16\n1.0\n3.095213 5.318908 0.000000\n-3.095213 5.318908 0.000000\n0.000000 0.003330 9.964414\nCr Sb Te O\n3 3 2 16\ndirect\n0.832064 0.336779 0.211488 Cr\n0.336779 0.832064 0.211488 Cr\n0.169230 0.169230 0.710911 Cr\n0.834887 0.834887 0.212764 Sb\n0.169567 0.668925 0.714014 Sb\n0.668925 0.169567 0.714014 Sb\n0.654828 0.654828 0.472621 Te\n0.321314 0.321314 0.000909 Te\n0.842044 0.309331 0.606067 O\n0.521133 0.521133 0.331277 O\n0.669767 0.669767 0.113521 O\n0.001160 0.001160 0.305807 O\n0.002813 0.002813 0.816931 O\n0.309331 0.842044 0.606067 O\n0.956071 0.522336 0.333924 O\n0.522336 0.956071 0.333924 O\n0.163138 0.163138 0.104977 O\n0.843471 0.843471 0.611407 O\n0.482262 0.042655 0.826941 O\n0.042655 0.482262 0.826941 O\n0.335959 0.335959 0.607136 O\n0.673584 0.158352 0.109001 O\n0.488630 0.488630 0.824634 O\n0.158352 0.673584 0.109001 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Cr",
"Sb",
"Te",
"O"
],
"chemical_system": "Cr-O-Sb-Te",
"density": 5.225489837990775,
"density_atomic": 0.07315035928554996,
"volume": 328.09134820942614,
"volume_molar": 8.23255117106391,
"formula_full": "Cr3 Sb3 Te2 O16",
"formula_reduced": "Cr3Sb3(TeO8)2",
"formula_anonymous": "A2B3C3D16",
"energy": -170.72071137,
"energy_per_atom": -7.11336297375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -153.73171137,
"band_gap": 1.3007,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.0004322,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:48.266000Z",
"spacegroup": 8
},
{
"id": "mp-849071",
"created_at": "2022-09-04T14:41:45.272694Z",
"structure_string": "Cr6 S8\n1.0\n3.322638 0.000000 -0.903426\n-0.704547 5.306878 -2.591192\n2.568562 5.221365 9.446699\nCr S\n6 8\ndirect\n0.000000 0.997803 0.000172 Cr\n0.500000 0.503089 0.503869 Cr\n0.500000 0.468396 0.238737 Cr\n0.000000 0.985829 0.741734 Cr\n0.000000 0.031549 0.257384 Cr\n0.500000 0.513930 0.757225 Cr\n0.000000 0.331869 0.118315 S\n0.500000 0.832019 0.625359 S\n0.500000 0.843162 0.137538 S\n0.000000 0.341228 0.636123 S\n0.000000 0.659026 0.364553 S\n0.500000 0.157848 0.864657 S\n0.500000 0.166008 0.380078 S\n0.000000 0.668243 0.874255 S\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Cr",
"S"
],
"chemical_system": "Cr-S",
"density": 4.155636022948303,
"density_atomic": 0.06162948928918402,
"volume": 227.16397882688605,
"volume_molar": 9.77152468640834,
"formula_full": "Cr6 S8",
"formula_reduced": "Cr3S4",
"formula_anonymous": "A3B4",
"energy": -103.96329643,
"energy_per_atom": -7.425949745,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -99.93929643,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 17.8785457,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.691000Z",
"spacegroup": 11
},
{
"id": "mp-964",
"created_at": "2022-09-04T14:44:05.626961Z",
"structure_string": "Cr3 S4\n1.0\n1.736633 6.338407 0.000000\n-1.736633 6.338407 0.000000\n0.000000 2.760570 5.421403\nCr S\n3 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.735908 0.735908 0.280215 Cr\n0.264092 0.264092 0.719785 Cr\n0.124913 0.124913 0.551128 S\n0.634213 0.634213 0.019461 S\n0.365787 0.365787 0.980539 S\n0.875087 0.875087 0.448872 S\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Cr",
"S"
],
"chemical_system": "Cr-S",
"density": 3.9547325108289515,
"density_atomic": 0.05865002217995084,
"volume": 119.35204352561878,
"volume_molar": 10.267925801498901,
"formula_full": "Cr3 S4",
"formula_reduced": "Cr3S4",
"formula_anonymous": "A3B4",
"energy": -52.12772349,
"energy_per_atom": -7.446817641428572,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -50.11572349,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.6331221,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:28.768000Z",
"spacegroup": 12
}
]
}