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=-decomposes_to&page=96",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-decomposes_to&page=94",
"results": [
{
"id": "mp-862748",
"created_at": "2022-09-04T14:44:13.456371Z",
"structure_string": "Sr2 Mn1 Zn2 As2 O2\n1.0\n0.000246 -4.199463 0.000161\n-4.199463 0.000246 0.000161\n2.099969 2.099969 -9.433642\nSr Mn Zn As O\n2 1 2 2 2\ndirect\n0.586523 0.586522 0.173043 Sr\n0.413479 0.413478 0.826956 Sr\n0.999995 0.000001 0.000004 Mn\n0.749993 0.250008 0.499999 Zn\n0.250008 0.749992 0.499999 Zn\n0.168627 0.168626 0.337435 As\n0.831374 0.831373 0.662564 As\n0.500002 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Sr",
"Mn",
"Zn",
"As",
"O"
],
"chemical_system": "As-Mn-O-Sr-Zn",
"density": 5.418260490325081,
"density_atomic": 0.05409822486285811,
"volume": 166.3640539558457,
"volume_molar": 11.131863892514861,
"formula_full": "Sr2 Mn1 Zn2 As2 O2",
"formula_reduced": "Sr2MnZn2(AsO)2",
"formula_anonymous": "AB2C2D2E2",
"energy": -47.83336497,
"energy_per_atom": -5.31481833,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -44.79136497,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.9298525,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.384000Z",
"spacegroup": 139
},
{
"id": "mp-1207784",
"created_at": "2022-09-04T14:44:13.689069Z",
"structure_string": "Y10 Co4 Te4\n1.0\n1.969160 -7.550703 0.000000\n1.969160 7.550703 0.000000\n0.000000 0.000000 15.021069\nY Co Te\n10 4 4\ndirect\n0.960777 0.039223 0.124339 Y\n0.039223 0.960777 0.875661 Y\n0.039223 0.960777 0.624339 Y\n0.960777 0.039223 0.375661 Y\n0.742315 0.257685 0.628913 Y\n0.257685 0.742315 0.371087 Y\n0.257685 0.742315 0.128913 Y\n0.742315 0.257685 0.871087 Y\n0.604847 0.395153 0.250000 Y\n0.395153 0.604847 0.750000 Y\n0.409369 0.590631 0.250000 Co\n0.590631 0.409369 0.750000 Co\n0.820932 0.179068 0.250000 Co\n0.179068 0.820932 0.750000 Co\n0.616830 0.383170 0.038654 Te\n0.383170 0.616830 0.961346 Te\n0.383170 0.616830 0.538654 Te\n0.616830 0.383170 0.461346 Te\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Y",
"Co",
"Te"
],
"chemical_system": "Co-Te-Y",
"density": 6.078808050057713,
"density_atomic": 0.04029705193732134,
"volume": 446.6828002206583,
"volume_molar": 14.94437054444313,
"formula_full": "Y10 Co4 Te4",
"formula_reduced": "Y5(CoTe)2",
"formula_anonymous": "A2B2C5",
"energy": -120.68887905,
"energy_per_atom": -6.704937725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -119.00087905,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 4.96e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.513000Z",
"spacegroup": 63
},
{
"id": "mp-37498",
"created_at": "2022-09-04T14:44:12.811050Z",
"structure_string": "Li10 N2 Cl4\n1.0\n3.659273 0.000000 0.000000\n0.000000 6.759009 0.000000\n0.000000 0.788558 9.215390\nLi N Cl\n10 2 4\ndirect\n0.500000 0.469133 0.729987 Li\n0.000000 0.039149 0.746786 Li\n0.000000 0.960851 0.253214 Li\n0.000000 0.372079 0.435934 Li\n0.000000 0.675214 0.107370 Li\n0.000000 0.324786 0.892630 Li\n0.500000 0.530867 0.270013 Li\n0.500000 0.786155 0.401782 Li\n0.000000 0.627921 0.564066 Li\n0.500000 0.213845 0.598218 Li\n0.000000 0.335716 0.666542 N\n0.000000 0.664284 0.333458 N\n0.500000 0.834160 0.660974 Cl\n0.000000 0.000000 0.000000 Cl\n0.500000 0.500000 0.000000 Cl\n0.500000 0.165840 0.339026 Cl\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"N",
"Cl"
],
"chemical_system": "Cl-Li-N",
"density": 1.7429422003981563,
"density_atomic": 0.07019859616741737,
"volume": 227.92478587237602,
"volume_molar": 8.578719645101923,
"formula_full": "Li10 N2 Cl4",
"formula_reduced": "Li5NCl2",
"formula_anonymous": "AB2C5",
"energy": -63.48678225,
"energy_per_atom": -3.967923890625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -60.30878225,
"band_gap": 1.9488,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0021903,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:27.541000Z",
"spacegroup": 10
},
{
"id": "mp-1221110",
"created_at": "2022-09-04T14:44:12.814360Z",
"structure_string": "Na1 Cd3 Rh8 O16\n1.0\n0.000000 -3.118071 0.000000\n-9.226755 0.000000 0.020059\n0.024226 0.000000 -11.004461\nNa Cd Rh O\n1 3 8 16\ndirect\n0.750000 0.734660 0.158507 Na\n0.750000 0.235690 0.338370 Cd\n0.250000 0.264436 0.839030 Cd\n0.250000 0.763500 0.662022 Cd\n0.750000 0.091139 0.596828 Rh\n0.750000 0.592690 0.903302 Rh\n0.250000 0.905869 0.398279 Rh\n0.250000 0.411381 0.099650 Rh\n0.750000 0.049575 0.117498 Rh\n0.750000 0.556376 0.382163 Rh\n0.250000 0.946141 0.884744 Rh\n0.250000 0.446248 0.615866 Rh\n0.750000 0.085783 0.932257 O\n0.750000 0.585885 0.568768 O\n0.250000 0.915018 0.069096 O\n0.250000 0.413338 0.429213 O\n0.750000 0.963992 0.290913 O\n0.750000 0.448210 0.214996 O\n0.250000 0.049570 0.711908 O\n0.250000 0.549408 0.787160 O\n0.750000 0.304013 0.663553 O\n0.750000 0.804230 0.837435 O\n0.250000 0.692850 0.339406 O\n0.250000 0.194824 0.165414 O\n0.750000 0.385423 0.969838 O\n0.750000 0.881852 0.528747 O\n0.250000 0.615175 0.025736 O\n0.250000 0.112719 0.469301 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Na",
"Cd",
"Rh",
"O"
],
"chemical_system": "Cd-Na-O-Rh",
"density": 7.549986212860335,
"density_atomic": 0.08844155001527744,
"volume": 316.59327539107204,
"volume_molar": 6.809175957408857,
"formula_full": "Na1 Cd3 Rh8 O16",
"formula_reduced": "NaCd3(RhO2)8",
"formula_anonymous": "AB3C8D16",
"energy": -175.91921025,
"energy_per_atom": -6.2828289375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -164.92721025,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.2890898,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:31.881000Z",
"spacegroup": 6
},
{
"id": "mp-1186354",
"created_at": "2022-09-04T14:44:12.817651Z",
"structure_string": "Os3 F1\n1.0\n0.000000 3.005195 3.005195\n3.005195 0.000000 3.005195\n3.005195 3.005195 0.000000\nOs F\n3 1\ndirect\n0.750000 0.750000 0.750000 Os\n0.250000 0.250000 0.250000 Os\n0.500000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Os",
"F"
],
"chemical_system": "F-Os",
"density": 18.03946760069141,
"density_atomic": 0.07369058816476011,
"volume": 54.28101606485558,
"volume_molar": 8.17219798345954,
"formula_full": "Os3 F1",
"formula_reduced": "Os3F",
"formula_anonymous": "AB3",
"energy": -34.177063710000006,
"energy_per_atom": -8.544265927500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -33.71506371,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006038,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:31.647000Z",
"spacegroup": 225
},
{
"id": "mp-30084",
"created_at": "2022-09-04T14:44:12.834128Z",
"structure_string": "Al4 Fe2 O8\n1.0\n5.047059 -0.045969 2.951607\n-5.017983 0.005168 2.901292\n-1.638499 -4.773854 2.951331\nAl Fe O\n4 2 8\ndirect\n0.500013 0.000012 0.500004 Al\n0.000015 0.500029 0.499987 Al\n0.000004 0.500017 0.000020 Al\n0.000001 0.999990 0.500018 Al\n0.374964 0.249709 0.875052 Fe\n0.624955 0.750192 0.124852 Fe\n0.203071 0.469438 0.262224 O\n0.231686 0.969494 0.733611 O\n0.237837 0.969497 0.296904 O\n0.233608 0.530522 0.731689 O\n0.762208 0.030568 0.703083 O\n0.766365 0.469491 0.268340 O\n0.796928 0.530517 0.737827 O\n0.768345 0.030523 0.266388 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Fe",
"O"
],
"chemical_system": "Al-Fe-O",
"density": 4.115686768641791,
"density_atomic": 0.09982223720697295,
"volume": 140.2493110925994,
"volume_molar": 6.032864949233308,
"formula_full": "Al4 Fe2 O8",
"formula_reduced": "Al2FeO4",
"formula_anonymous": "AB2C4",
"energy": -112.15590881999998,
"energy_per_atom": -8.011136344285713,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -102.14790882,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:29.725000Z",
"spacegroup": 227
},
{
"id": "mp-1207329",
"created_at": "2022-09-04T14:44:12.837658Z",
"structure_string": "Ho2 Cu1 As3\n1.0\n12.924958 0.000000 -0.000000\n0.000000 12.924958 0.000000\n0.000000 0.000000 44.336875\nHo Cu As\n2 1 3\ndirect\n0.500000 0.500000 0.248965 Ho\n0.500000 0.500000 0.751035 Ho\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 0.696754 As\n0.500000 0.500000 0.303246 As\n0.500000 0.500000 -0.000000 As\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ho",
"Cu",
"As"
],
"chemical_system": "As-Cu-Ho",
"density": 0.1385908867200144,
"density_atomic": 0.0008100799624481839,
"volume": 7406.676227204898,
"volume_molar": 743.4007800662273,
"formula_full": "Ho2 Cu1 As3",
"formula_reduced": "Ho2CuAs3",
"formula_anonymous": "AB2C3",
"energy": -12.622890950000002,
"energy_per_atom": -2.1038151583333335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.622890950000002,
"band_gap": 0.1493999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.9676264,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:37.766000Z",
"spacegroup": 123
},
{
"id": "mp-19159",
"created_at": "2022-09-04T14:44:12.846755Z",
"structure_string": "Ca2 Pd1 W1 O6\n1.0\n0.000000 4.068385 4.068385\n4.068385 0.000000 4.068385\n4.068385 4.068385 0.000000\nCa Pd W O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Pd\n0.000000 0.000000 0.000000 W\n0.762673 0.237327 0.762673 O\n0.237327 0.237327 0.762673 O\n0.762673 0.762673 0.237327 O\n0.762673 0.237327 0.237327 O\n0.237327 0.762673 0.237327 O\n0.237327 0.762673 0.762673 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ca",
"Pd",
"W",
"O"
],
"chemical_system": "Ca-O-Pd-W",
"density": 5.75073104439462,
"density_atomic": 0.07425126740672885,
"volume": 134.67783580342996,
"volume_molar": 8.110488844604228,
"formula_full": "Ca2 Pd1 W1 O6",
"formula_reduced": "Ca2PdWO6",
"formula_anonymous": "ABC2D6",
"energy": -73.64830481,
"energy_per_atom": -7.364830481,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -65.08830481,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.7778904,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:31.533000Z",
"spacegroup": 225
},
{
"id": "mp-867206",
"created_at": "2022-09-04T14:44:12.851154Z",
"structure_string": "Li1 Cd2 Pt1\n1.0\n0.000000 3.286235 3.286235\n3.286235 0.000000 3.286235\n3.286235 3.286235 0.000000\nLi Cd Pt\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.750000 0.750000 0.750000 Cd\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cd",
"Pt"
],
"chemical_system": "Cd-Li-Pt",
"density": 9.98609020789973,
"density_atomic": 0.05635521945316437,
"volume": 70.97834129320205,
"volume_molar": 10.686039054474579,
"formula_full": "Li1 Cd2 Pt1",
"formula_reduced": "LiCd2Pt",
"formula_anonymous": "ABC2",
"energy": -11.53765885,
"energy_per_atom": -2.8844147125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.53765885,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005424,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.263000Z",
"spacegroup": 225
},
{
"id": "mp-1077034",
"created_at": "2022-09-04T14:44:12.864345Z",
"structure_string": "Nd2 Mg2 Sn2\n1.0\n-2.258361 2.258361 8.112401\n2.258361 -2.258361 8.112401\n2.258361 2.258361 -8.112401\nNd Mg Sn\n2 2 2\ndirect\n0.664355 0.664355 0.000000 Nd\n0.335645 0.335645 0.000000 Nd\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.866879 0.866879 0.000000 Sn\n0.133121 0.133121 0.000000 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"Mg",
"Sn"
],
"chemical_system": "Mg-Nd-Sn",
"density": 5.764392996362888,
"density_atomic": 0.03625393222659698,
"volume": 165.49928880813152,
"volume_molar": 16.611000214707676,
"formula_full": "Nd2 Mg2 Sn2",
"formula_reduced": "NdMgSn",
"formula_anonymous": "ABC",
"energy": -24.36869771,
"energy_per_atom": -4.0614496183333335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.36869771,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009541,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:28.015000Z",
"spacegroup": 139
},
{
"id": "mp-1517195",
"created_at": "2022-09-04T14:44:12.867937Z",
"structure_string": "Sr2 Ca2 Pr2 Sb2 O12\n1.0\n5.923544 0.000000 0.000000\n-0.000000 5.923544 0.000000\n0.000000 0.000000 8.606617\nSr Ca Pr Sb O\n2 2 2 2 12\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 -0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Ca\n-0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 0.752402 Pr\n0.000000 0.500000 0.247598 Pr\n0.500000 -0.000000 0.245243 Sb\n0.000000 0.500000 0.754757 Sb\n0.500000 0.000000 0.014806 O\n-0.000000 0.500000 0.985194 O\n0.500000 -0.000000 0.480369 O\n-0.000000 0.500000 0.519631 O\n0.695210 0.651608 0.757286 O\n0.304790 0.348392 0.757286 O\n0.848392 0.195210 0.757286 O\n0.151608 0.804790 0.757286 O\n0.804790 0.151608 0.242714 O\n0.195210 0.848392 0.242714 O\n0.651608 0.695210 0.242714 O\n0.348392 0.304790 0.242714 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Sr",
"Ca",
"Pr",
"Sb",
"O"
],
"chemical_system": "Ca-O-Pr-Sb-Sr",
"density": 5.348636195417138,
"density_atomic": 0.06622687780422845,
"volume": 301.992192039031,
"volume_molar": 9.093197444399982,
"formula_full": "Sr2 Ca2 Pr2 Sb2 O12",
"formula_reduced": "SrCaPrSbO6",
"formula_anonymous": "ABCDE6",
"energy": -143.36546436,
"energy_per_atom": -7.168273218,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -135.12146436,
"band_gap": 3.1795,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.7e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:31.155000Z",
"spacegroup": 90
},
{
"id": "mp-1211477",
"created_at": "2022-09-04T14:44:09.132986Z",
"structure_string": "La12 As4 Br12\n1.0\n-6.106188 6.106188 6.106188\n6.106188 -6.106188 6.106188\n6.106188 6.106188 -6.106188\nLa As Br\n12 4 12\ndirect\n0.481624 0.490812 0.240812 La\n0.750000 0.240812 0.259188 La\n0.750000 0.009188 0.490812 La\n0.240812 0.481624 0.490812 La\n0.259188 0.750000 0.240812 La\n0.018376 0.259188 0.009188 La\n0.009188 0.018376 0.259188 La\n0.490812 0.750000 0.009188 La\n0.490812 0.240812 0.481624 La\n0.009188 0.490812 0.750000 La\n0.259188 0.009188 0.018376 La\n0.240812 0.259188 0.750000 La\n0.250000 0.250000 0.250000 As\n0.500000 0.000000 0.250000 As\n0.000000 0.250000 0.500000 As\n0.250000 0.500000 0.000000 As\n0.250000 0.754838 0.745162 Br\n0.509676 0.504838 0.754838 Br\n0.990324 0.745162 0.995162 Br\n0.745162 0.250000 0.754838 Br\n0.995162 0.990324 0.745162 Br\n0.250000 0.995162 0.504838 Br\n0.754838 0.509676 0.504838 Br\n0.504838 0.250000 0.995162 Br\n0.754838 0.745162 0.250000 Br\n0.745162 0.995162 0.990324 Br\n0.995162 0.504838 0.250000 Br\n0.504838 0.754838 0.509676 Br\n",
"nsites": 28,
"nelements": 3,
"elements": [
"La",
"As",
"Br"
],
"chemical_system": "As-Br-La",
"density": 5.3341331816994915,
"density_atomic": 0.03074592233165812,
"volume": 910.6898696341684,
"volume_molar": 19.586794941582184,
"formula_full": "La12 As4 Br12",
"formula_reduced": "La3AsBr3",
"formula_anonymous": "AB3C3",
"energy": -151.79683383,
"energy_per_atom": -5.421315493928572,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -145.38883383,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0020125,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:32.633000Z",
"spacegroup": 214
}
]
}