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=62",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=60",
"results": [
{
"id": "mp-1520963",
"created_at": "2022-09-04T14:41:10.840065Z",
"structure_string": "Sr1 Sm1 Mn1 Sn1 O6\n1.0\n-0.000000 -4.013909 -4.013909\n4.013909 0.000000 -4.013909\n4.013909 -4.013909 -0.000000\nSr Sm Mn Sn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sm\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Sn\n0.753344 0.246656 0.246656 O\n0.246656 0.753344 0.753344 O\n0.753344 0.246656 0.753344 O\n0.246656 0.753344 0.246656 O\n0.753344 0.753344 0.246656 O\n0.246656 0.246656 0.753344 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Sm",
"Mn",
"Sn",
"O"
],
"chemical_system": "Mn-O-Sm-Sn-Sr",
"density": 6.517170193308492,
"density_atomic": 0.07731565463626004,
"volume": 129.33991242842208,
"volume_molar": 7.789031585300312,
"formula_full": "Sr1 Sm1 Mn1 Sn1 O6",
"formula_reduced": "SrSmMnSnO6",
"formula_anonymous": "ABCDE6",
"energy": -75.38883969000001,
"energy_per_atom": -7.538883969000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -69.59883969,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.0000008,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:12.144000Z",
"spacegroup": 216
},
{
"id": "mp-1518308",
"created_at": "2022-09-04T14:41:24.727762Z",
"structure_string": "Pr1 Eu1 Nb1 Zn1 O6\n1.0\n-0.000000 -4.032463 -4.032463\n4.032463 -0.000000 -4.032463\n4.032463 -4.032463 0.000000\nPr Eu Nb Zn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Pr\n0.750000 0.750000 0.750000 Eu\n0.000000 -0.000000 -0.000000 Nb\n0.500000 0.500000 0.500000 Zn\n0.752989 0.247011 0.247011 O\n0.247011 0.752989 0.752989 O\n0.752989 0.247011 0.752989 O\n0.247011 0.752989 0.247011 O\n0.752989 0.752989 0.247011 O\n0.247011 0.247011 0.752989 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Pr",
"Eu",
"Nb",
"Zn",
"O"
],
"chemical_system": "Eu-Nb-O-Pr-Zn",
"density": 6.928526233369559,
"density_atomic": 0.07625333291090924,
"volume": 131.14180873488536,
"volume_molar": 7.897544317224772,
"formula_full": "Pr1 Eu1 Nb1 Zn1 O6",
"formula_reduced": "PrEuNbZnO6",
"formula_anonymous": "ABCDE6",
"energy": -85.56665226999999,
"energy_per_atom": -8.556665227,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -81.44465227,
"band_gap": 0.3793999999999995,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 7.0000002,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:21.588000Z",
"spacegroup": 216
},
{
"id": "mp-1520657",
"created_at": "2022-09-04T14:40:11.329146Z",
"structure_string": "Ba1 Sr1 Hf1 Sn1 O6\n1.0\n-0.000000 -4.159723 -4.159723\n4.159723 -0.000000 -4.159723\n4.159723 -4.159723 0.000000\nBa Sr Hf Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Sr\n-0.000000 0.000000 -0.000000 Hf\n0.500000 0.500000 0.500000 Sn\n0.750000 0.250000 0.250000 O\n0.250000 0.750000 0.750000 O\n0.750000 0.250000 0.750000 O\n0.250000 0.750000 0.250000 O\n0.750000 0.750000 0.250000 O\n0.250000 0.250000 0.750000 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Sr",
"Hf",
"Sn",
"O"
],
"chemical_system": "Ba-Hf-O-Sn-Sr",
"density": 7.130419872424969,
"density_atomic": 0.0694667162417065,
"volume": 143.9538320079133,
"volume_molar": 8.669102392930473,
"formula_full": "Ba1 Sr1 Hf1 Sn1 O6",
"formula_reduced": "BaSrHfSnO6",
"formula_anonymous": "ABCDE6",
"energy": -79.28985887,
"energy_per_atom": -7.9289858870000005,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -75.16785887,
"band_gap": 3.7375,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:49.015000Z",
"spacegroup": 216
},
{
"id": "mp-1516720",
"created_at": "2022-09-04T14:42:10.045538Z",
"structure_string": "Sr1 Ca1 Ti1 Nb1 O6\n1.0\n-0.000000 -3.994793 -3.994793\n3.994793 -0.000000 -3.994793\n3.994793 -3.994793 0.000000\nSr Ca Ti Nb O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 Ti\n-0.000000 -0.000000 -0.000000 Nb\n0.747307 0.252693 0.252693 O\n0.252693 0.747307 0.747307 O\n0.747307 0.252693 0.747307 O\n0.252693 0.747307 0.252693 O\n0.747307 0.747307 0.252693 O\n0.252693 0.252693 0.747307 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Ca",
"Ti",
"Nb",
"O"
],
"chemical_system": "Ca-Nb-O-Sr-Ti",
"density": 4.746739546834411,
"density_atomic": 0.07843089370471645,
"volume": 127.5007784260228,
"volume_molar": 7.678276346910806,
"formula_full": "Sr1 Ca1 Ti1 Nb1 O6",
"formula_reduced": "SrCaTiNbO6",
"formula_anonymous": "ABCDE6",
"energy": -84.73100374,
"energy_per_atom": -8.473100374000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -80.60900374,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.1e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:46.804000Z",
"spacegroup": 216
},
{
"id": "mp-1522354",
"created_at": "2022-09-04T14:42:09.731285Z",
"structure_string": "Sr1 Ce1 Eu1 Nb1 O6\n1.0\n0.000000 -4.273190 -4.273190\n4.273190 0.000000 -4.273190\n4.273190 -4.273190 0.000000\nSr Ce Eu Nb 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 Eu\n0.500000 0.500000 0.500000 Nb\n0.737125 0.262875 0.262875 O\n0.262875 0.737125 0.737125 O\n0.737125 0.262875 0.737125 O\n0.262875 0.737125 0.262875 O\n0.737125 0.737125 0.262875 O\n0.262875 0.262875 0.737125 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Ce",
"Eu",
"Nb",
"O"
],
"chemical_system": "Ce-Eu-Nb-O-Sr",
"density": 6.050224226901225,
"density_atomic": 0.06407865599347337,
"volume": 156.05820448260548,
"volume_molar": 9.398044741471132,
"formula_full": "Sr1 Ce1 Eu1 Nb1 O6",
"formula_reduced": "SrCeEuNbO6",
"formula_anonymous": "ABCDE6",
"energy": -90.36380246,
"energy_per_atom": -9.036380246,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -86.24180246,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.9999996,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:39.636000Z",
"spacegroup": 216
},
{
"id": "mp-1522306",
"created_at": "2022-09-04T14:45:22.881536Z",
"structure_string": "Ba1 Sr1 Nd1 Nb1 O6\n1.0\n0.000000 -4.332691 -4.332691\n4.332691 -0.000000 -4.332691\n4.332691 -4.332691 0.000000\nBa Sr Nd Nb 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 Nd\n0.000000 0.000000 -0.000000 Nb\n0.767319 0.232681 0.232681 O\n0.232681 0.767319 0.767319 O\n0.767319 0.232681 0.767319 O\n0.232681 0.767319 0.232681 O\n0.767319 0.767319 0.232681 O\n0.232681 0.232681 0.767319 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Sr",
"Nd",
"Nb",
"O"
],
"chemical_system": "Ba-Nb-Nd-O-Sr",
"density": 5.697070276013379,
"density_atomic": 0.0614747616129034,
"volume": 162.66838191205,
"volume_molar": 9.79611893075803,
"formula_full": "Ba1 Sr1 Nd1 Nb1 O6",
"formula_reduced": "BaSrNdNbO6",
"formula_anonymous": "ABCDE6",
"energy": -81.33646479999999,
"energy_per_atom": -8.13364648,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -77.2144648,
"band_gap": 2.869800000000001,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:09.623000Z",
"spacegroup": 216
},
{
"id": "mp-1518460",
"created_at": "2022-09-04T14:41:35.427132Z",
"structure_string": "Ba2 Nd2 Eu2 Nb2 O12\n1.0\n6.051590 0.013842 0.018253\n0.017278 6.111222 -0.028276\n0.030073 -0.035915 8.600799\nBa Nd Eu Nb O\n2 2 2 2 12\ndirect\n0.992180 0.031616 0.249986 Ba\n0.007820 0.968384 0.750014 Ba\n0.500000 -0.000000 -0.000000 Nd\n0.000000 0.500000 0.500000 Nd\n0.508145 0.539575 0.251586 Eu\n0.491855 0.460425 0.748414 Eu\n0.000000 0.500000 -0.000000 Nb\n0.500000 -0.000000 0.500000 Nb\n0.195176 0.233281 0.958123 O\n0.314317 0.723634 0.544358 O\n0.804824 0.766719 0.041877 O\n0.685683 0.276366 0.455642 O\n0.272506 0.689381 0.954196 O\n0.234457 0.198348 0.539291 O\n0.727494 0.310619 0.045804 O\n0.765543 0.801652 0.460709 O\n0.430068 0.970839 0.268930 O\n0.090983 0.488752 0.230331 O\n0.569932 0.029161 0.731070 O\n0.909017 0.511248 0.769669 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Ba",
"Nd",
"Eu",
"Nb",
"O"
],
"chemical_system": "Ba-Eu-Nb-Nd-O",
"density": 6.499098196982975,
"density_atomic": 0.06287955388557373,
"volume": 318.0684143592269,
"volume_molar": 9.577263812906347,
"formula_full": "Ba2 Nd2 Eu2 Nb2 O12",
"formula_reduced": "BaNdEuNbO6",
"formula_anonymous": "ABCDE6",
"energy": -180.59722321000004,
"energy_per_atom": -9.029861160500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -172.35322321,
"band_gap": 0.1223,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 13.9999907,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:30.784000Z",
"spacegroup": 2
},
{
"id": "mp-1520883",
"created_at": "2022-09-04T14:39:44.572371Z",
"structure_string": "Sr2 Sm2 Eu2 Sb2 O12\n1.0\n5.867911 -0.003302 0.016430\n0.001644 6.008971 -0.007503\n0.030919 -0.003234 8.394744\nSr Sm Eu Sb O\n2 2 2 2 12\ndirect\n0.512482 0.547291 0.250913 Sr\n0.487518 0.452709 0.749087 Sr\n0.500000 -0.000000 -0.000000 Sm\n-0.000000 0.500000 0.500000 Sm\n0.986677 0.048741 0.248852 Eu\n0.013323 0.951259 0.751148 Eu\n-0.000000 0.500000 -0.000000 Sb\n0.500000 -0.000000 0.500000 Sb\n0.183020 0.220358 0.948788 O\n0.314521 0.722609 0.550490 O\n0.816980 0.779642 0.051212 O\n0.685479 0.277391 0.449510 O\n0.276900 0.690454 0.951785 O\n0.221951 0.188539 0.550577 O\n0.723100 0.309546 0.048215 O\n0.778049 0.811461 0.449423 O\n0.402580 0.973037 0.268351 O\n0.090348 0.468342 0.231780 O\n0.597420 0.026963 0.731649 O\n0.909652 0.531658 0.768220 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Sr",
"Sm",
"Eu",
"Sb",
"O"
],
"chemical_system": "Eu-O-Sb-Sm-Sr",
"density": 6.818394924795037,
"density_atomic": 0.06756838404018699,
"volume": 295.99642323996966,
"volume_molar": 8.912660626038164,
"formula_full": "Sr2 Sm2 Eu2 Sb2 O12",
"formula_reduced": "SrSmEuSbO6",
"formula_anonymous": "ABCDE6",
"energy": -161.81457548,
"energy_per_atom": -8.090728774,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -153.57057548,
"band_gap": 0.0192999999999994,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 13.999957,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:32.148000Z",
"spacegroup": 2
},
{
"id": "mp-1520449",
"created_at": "2022-09-04T14:42:37.863313Z",
"structure_string": "Sr1 Ca1 Tb1 Bi1 O6\n1.0\n-0.000000 -4.292976 -4.292976\n4.292976 -0.000000 -4.292976\n4.292976 -4.292976 0.000000\nSr Ca Tb Bi O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 Tb\n-0.000000 -0.000000 -0.000000 Bi\n0.756058 0.243942 0.243942 O\n0.243942 0.756058 0.756058 O\n0.756058 0.243942 0.756058 O\n0.243942 0.756058 0.243942 O\n0.756058 0.756058 0.243942 O\n0.243942 0.243942 0.756058 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Ca",
"Tb",
"Bi",
"O"
],
"chemical_system": "Bi-Ca-O-Sr-Tb",
"density": 6.208290003072515,
"density_atomic": 0.06319673226980035,
"volume": 158.23602963058062,
"volume_molar": 9.529196437388872,
"formula_full": "Sr1 Ca1 Tb1 Bi1 O6",
"formula_reduced": "SrCaTbBiO6",
"formula_anonymous": "ABCDE6",
"energy": -68.61881829,
"energy_per_atom": -6.861881829,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -64.49681829,
"band_gap": 2.0534000000000003,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:04.512000Z",
"spacegroup": 216
},
{
"id": "mp-1223657",
"created_at": "2022-09-04T14:42:43.230889Z",
"structure_string": "K2 Cr2 Ni2 O2 F12\n1.0\n-3.750156 3.805242 5.212238\n3.750156 -3.805242 5.212238\n3.750156 3.805242 -5.212238\nK Cr Ni O F\n2 2 2 2 12\ndirect\n0.500000 0.500000 0.000000 K\n0.000000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.961295 0.711295 0.250000 O\n0.038705 0.288705 0.750000 O\n0.563467 0.934833 0.255978 F\n0.178854 0.934833 0.871365 F\n0.573829 0.323829 0.250000 F\n0.178854 0.307489 0.244022 F\n0.563467 0.307489 0.628635 F\n0.187933 0.937933 0.250000 F\n0.436533 0.065167 0.744022 F\n0.821146 0.065167 0.128635 F\n0.426171 0.676171 0.750000 F\n0.821146 0.692511 0.755978 F\n0.436533 0.692511 0.371365 F\n0.812067 0.062067 0.750000 F\n",
"nsites": 20,
"nelements": 5,
"elements": [
"K",
"Cr",
"Ni",
"O",
"F"
],
"chemical_system": "Cr-F-K-Ni-O",
"density": 3.1230304468039223,
"density_atomic": 0.06722242118113757,
"volume": 297.5197805819578,
"volume_molar": 8.958529987744322,
"formula_full": "K2 Cr2 Ni2 O2 F12",
"formula_reduced": "KCrNiOF6",
"formula_anonymous": "ABCDE6",
"energy": -112.3868815,
"energy_per_atom": -5.619344075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -96.3888815,
"band_gap": 0.4728000000000001,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 14.0000001,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:57.398000Z",
"spacegroup": 74
},
{
"id": "mp-1189143",
"created_at": "2022-09-04T14:41:25.383958Z",
"structure_string": "Na2 Nd2 Fe2 W2 O12\n1.0\n5.556015 0.000000 -0.024268\n0.000000 5.601518 0.000000\n-0.008650 0.000000 8.111660\nNa Nd Fe W O\n2 2 2 2 12\ndirect\n0.744809 0.992665 0.497991 Na\n0.255191 0.492665 0.502009 Na\n0.759675 0.062253 0.001345 Nd\n0.240325 0.562253 0.998655 Nd\n0.751413 0.517898 0.258685 Fe\n0.248587 0.017898 0.741315 Fe\n0.743151 0.512300 0.737982 W\n0.256849 0.012300 0.262018 W\n0.950577 0.784275 0.809509 O\n0.049423 0.284275 0.190491 O\n0.976209 0.807873 0.192403 O\n0.023791 0.307873 0.807597 O\n0.461236 0.701860 0.722344 O\n0.538764 0.201860 0.277656 O\n0.566743 0.219671 0.717242 O\n0.433257 0.719671 0.282758 O\n0.660787 0.487475 0.988224 O\n0.339213 0.987475 0.011776 O\n0.831304 0.538531 0.517367 O\n0.168696 0.038531 0.482633 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Na",
"Nd",
"Fe",
"W",
"O"
],
"chemical_system": "Fe-Na-Nd-O-W",
"density": 6.615996088777179,
"density_atomic": 0.07922333747003511,
"volume": 252.4508640849,
"volume_molar": 7.601473192514482,
"formula_full": "Na2 Nd2 Fe2 W2 O12",
"formula_reduced": "NaNdFeWO6",
"formula_anonymous": "ABCDE6",
"energy": -165.41289304999998,
"energy_per_atom": -8.2706446525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -143.78089305,
"band_gap": 2.4171,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 7.9999448,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:18.739000Z",
"spacegroup": 4
},
{
"id": "mp-1518315",
"created_at": "2022-09-04T14:42:38.128652Z",
"structure_string": "Sr1 Eu1 Dy1 Nb1 O6\n1.0\n0.000000 -4.214632 -4.214632\n4.214632 -0.000000 -4.214632\n4.214632 -4.214632 0.000000\nSr Eu Dy Nb 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 Dy\n0.500000 0.500000 0.500000 Nb\n0.738139 0.261861 0.261861 O\n0.261861 0.738139 0.738139 O\n0.738139 0.261861 0.738139 O\n0.261861 0.738139 0.261861 O\n0.738139 0.738139 0.261861 O\n0.261861 0.261861 0.738139 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Eu",
"Dy",
"Nb",
"O"
],
"chemical_system": "Dy-Eu-Nb-O-Sr",
"density": 6.554172797190732,
"density_atomic": 0.06678685970553448,
"volume": 149.7300523499733,
"volume_molar": 9.016954512537081,
"formula_full": "Sr1 Eu1 Dy1 Nb1 O6",
"formula_reduced": "SrEuDyNbO6",
"formula_anonymous": "ABCDE6",
"energy": -90.16530808,
"energy_per_atom": -9.016530808,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -86.04330808,
"band_gap": 0.3102999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0000002,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:01.332000Z",
"spacegroup": 216
}
]
}