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=-is_stable&page=108",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-is_stable&page=106",
"results": [
{
"id": "mp-26496",
"created_at": "2022-09-04T14:41:53.980155Z",
"structure_string": "Cr4 P4 O20\n1.0\n7.046956 -0.030830 -0.042300\n2.661393 6.875902 -0.236592\n0.005227 -0.014000 7.293787\nCr P O\n4 4 20\ndirect\n0.306201 0.457100 0.279919 Cr\n0.693799 0.542901 0.720081 Cr\n0.800472 0.947465 0.216009 Cr\n0.199528 0.052534 0.783991 Cr\n0.471904 0.759678 0.086197 P\n0.528096 0.240322 0.913803 P\n0.021119 0.243219 0.412839 P\n0.978880 0.756781 0.587161 P\n0.107173 0.340801 0.264282 O\n0.892827 0.659199 0.735718 O\n0.603140 0.333168 0.755691 O\n0.396860 0.666831 0.244309 O\n0.493506 0.295845 0.366876 O\n0.506493 0.704156 0.633124 O\n0.355352 0.393653 0.026713 O\n0.644647 0.606348 0.973287 O\n0.287048 0.858501 0.962708 O\n0.712953 0.141498 0.037292 O\n0.959131 0.088077 0.311617 O\n0.040870 0.911922 0.688383 O\n0.837890 0.392940 0.512883 O\n0.162111 0.607061 0.487117 O\n0.551772 0.909808 0.178598 O\n0.448228 0.090191 0.821402 O\n0.801617 0.851083 0.452115 O\n0.198384 0.148918 0.547885 O\n0.959941 0.766283 0.113261 O\n0.040060 0.233717 0.886739 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Cr",
"P",
"O"
],
"chemical_system": "Cr-O-P",
"density": 3.057835154819171,
"density_atomic": 0.07909767330914687,
"volume": 353.99271342109216,
"volume_molar": 7.6135498151291365,
"formula_full": "Cr4 P4 O20",
"formula_reduced": "CrPO5",
"formula_anonymous": "ABC5",
"energy": -220.1035144,
"energy_per_atom": -7.8608398,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -198.3675144,
"band_gap": 1.6195,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.0008843,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:32.753000Z",
"spacegroup": 2
},
{
"id": "mp-1095875",
"created_at": "2022-09-04T14:41:53.983180Z",
"structure_string": "Sc1 Zn1 Ir2\n1.0\n-4.730170 5.567392 7.867766\n4.730170 -5.567392 7.867766\n4.730170 5.567392 -7.867766\nSc Zn Ir\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Zn\n0.000000 0.238054 0.238054 Ir\n0.000000 0.761946 0.761946 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Zn",
"Ir"
],
"chemical_system": "Ir-Sc-Zn",
"density": 0.9913747580873983,
"density_atomic": 0.004826363353989294,
"volume": 828.781363237757,
"volume_molar": 124.77595071706156,
"formula_full": "Sc1 Zn1 Ir2",
"formula_reduced": "ScZnIr2",
"formula_anonymous": "ABC2",
"energy": -16.27264297,
"energy_per_atom": -4.0681607425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.27264297,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.2537211,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:32.038000Z",
"spacegroup": 71
},
{
"id": "mp-29997",
"created_at": "2022-09-04T14:41:53.988965Z",
"structure_string": "La12 As4 I12\n1.0\n-6.335705 6.335705 6.335705\n6.335705 -6.335705 6.335705\n6.335705 6.335705 -6.335705\nLa As I\n12 4 12\ndirect\n0.765343 0.530687 0.515343 La\n0.984657 0.515343 0.250000 La\n0.530687 0.515343 0.765343 La\n0.250000 0.765343 0.734657 La\n0.515343 0.765343 0.530687 La\n0.734657 0.250000 0.765343 La\n0.515343 0.250000 0.984657 La\n0.734657 0.984657 0.969313 La\n0.765343 0.734657 0.250000 La\n0.969313 0.734657 0.984657 La\n0.250000 0.984657 0.515343 La\n0.984657 0.969313 0.734657 La\n0.750000 0.750000 0.750000 As\n0.000000 0.750000 0.500000 As\n0.750000 0.500000 0.000000 As\n0.500000 0.000000 0.750000 As\n0.258690 0.750000 0.241310 I\n0.750000 0.008690 0.491310 I\n0.008690 0.491310 0.750000 I\n0.017381 0.258690 0.008690 I\n0.491310 0.241310 0.482619 I\n0.008690 0.017381 0.258690 I\n0.241310 0.482619 0.491310 I\n0.241310 0.258690 0.750000 I\n0.491310 0.750000 0.008690 I\n0.482619 0.491310 0.241310 I\n0.750000 0.241310 0.258690 I\n0.258690 0.008690 0.017381 I\n",
"nsites": 28,
"nelements": 3,
"elements": [
"La",
"As",
"I"
],
"chemical_system": "As-I-La",
"density": 5.69581305758783,
"density_atomic": 0.027524104438444674,
"volume": 1017.290137908742,
"volume_molar": 21.87951572945092,
"formula_full": "La12 As4 I12",
"formula_reduced": "La3AsI3",
"formula_anonymous": "AB3C3",
"energy": -141.83554103,
"energy_per_atom": -5.065555036785715,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -137.28754103,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.1272881,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:36.246000Z",
"spacegroup": 214
},
{
"id": "mp-1226772",
"created_at": "2022-09-04T14:41:53.990857Z",
"structure_string": "Ce2 Sb1 Te1\n1.0\n4.495653 0.000000 0.000000\n0.000000 4.495653 0.000000\n0.000000 0.000000 6.359340\nCe Sb Te\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Ce\n0.000000 0.000000 0.500000 Sb\n0.500000 0.500000 0.000000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ce",
"Sb",
"Te"
],
"chemical_system": "Ce-Sb-Te",
"density": 6.842154922447218,
"density_atomic": 0.031121633301819815,
"volume": 128.5279587098696,
"volume_molar": 19.35033647365757,
"formula_full": "Ce2 Sb1 Te1",
"formula_reduced": "Ce2SbTe",
"formula_anonymous": "ABC2",
"energy": -24.700284590000003,
"energy_per_atom": -6.175071147500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.08628459,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.122413,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:34.773000Z",
"spacegroup": 123
},
{
"id": "mp-646599",
"created_at": "2022-09-04T14:41:53.994018Z",
"structure_string": "K4 Co16 P12 O48\n1.0\n6.200488 0.000000 0.000000\n0.000000 9.826762 0.000000\n0.000000 0.000000 16.656623\nK Co P O\n4 16 12 48\ndirect\n0.500000 0.207374 0.965811 K\n0.500000 0.792626 0.034189 K\n0.000000 0.707374 0.534189 K\n0.000000 0.292626 0.465811 K\n0.500000 0.486518 0.361946 Co\n0.751198 0.744168 0.296349 Co\n0.748802 0.244168 0.203651 Co\n0.000000 0.470087 0.908562 Co\n0.000000 0.013482 0.861946 Co\n0.500000 0.970087 0.591438 Co\n0.748802 0.755832 0.796349 Co\n0.751198 0.255832 0.703651 Co\n0.251198 0.244168 0.203651 Co\n0.248802 0.255832 0.703651 Co\n0.000000 0.529913 0.091438 Co\n0.251198 0.755832 0.796349 Co\n0.248802 0.744168 0.296349 Co\n0.500000 0.029913 0.408562 Co\n0.500000 0.513482 0.638054 Co\n0.000000 0.986518 0.138054 Co\n0.500000 0.043471 0.782161 P\n0.500000 0.537601 0.164554 P\n0.500000 0.289885 0.536334 P\n0.500000 0.710115 0.463666 P\n0.000000 0.962399 0.664554 P\n0.000000 0.037601 0.335446 P\n0.500000 0.462399 0.835446 P\n0.500000 0.956529 0.217839 P\n0.000000 0.456529 0.282161 P\n0.000000 0.543471 0.717839 P\n0.000000 0.210115 0.036334 P\n0.000000 0.789885 0.963666 P\n0.500000 0.886517 0.771268 O\n0.500000 0.619503 0.820097 O\n0.701397 0.582320 0.118713 O\n0.500000 0.639108 0.544364 O\n0.000000 0.634381 0.979776 O\n0.000000 0.113014 0.249268 O\n0.000000 0.365619 0.020224 O\n0.500000 0.887946 0.304592 O\n0.000000 0.886986 0.750732 O\n0.000000 0.613483 0.271268 O\n0.300300 0.666881 0.411133 O\n0.000000 0.119503 0.679903 O\n0.199700 0.166881 0.088867 O\n0.300300 0.333119 0.588867 O\n0.000000 0.612054 0.804592 O\n0.500000 0.613014 0.250732 O\n0.500000 0.113483 0.228732 O\n0.201397 0.082320 0.381287 O\n0.500000 0.112054 0.695408 O\n0.207038 0.404675 0.323536 O\n0.000000 0.387946 0.195408 O\n0.798603 0.082320 0.381287 O\n0.701397 0.417680 0.881287 O\n0.707038 0.095325 0.823536 O\n0.800300 0.833119 0.911133 O\n0.792962 0.595325 0.676464 O\n0.201397 0.917680 0.618713 O\n0.707038 0.904675 0.176464 O\n0.699700 0.333119 0.588867 O\n0.292962 0.095325 0.823536 O\n0.000000 0.860892 0.044364 O\n0.792962 0.404675 0.323536 O\n0.500000 0.134381 0.520224 O\n0.798603 0.917680 0.618713 O\n0.699700 0.666881 0.411133 O\n0.298603 0.582320 0.118713 O\n0.000000 0.880497 0.320097 O\n0.000000 0.386517 0.728732 O\n0.298603 0.417680 0.881287 O\n0.800300 0.166881 0.088867 O\n0.292962 0.904675 0.176464 O\n0.500000 0.386986 0.749268 O\n0.207038 0.595325 0.676464 O\n0.500000 0.380497 0.179903 O\n0.500000 0.865619 0.479776 O\n0.500000 0.360892 0.455636 O\n0.199700 0.833119 0.911133 O\n0.000000 0.139108 0.955636 O\n",
"nsites": 80,
"nelements": 4,
"elements": [
"K",
"Co",
"P",
"O"
],
"chemical_system": "Co-K-O-P",
"density": 3.66333111900479,
"density_atomic": 0.07882549773287012,
"volume": 1014.9000298242343,
"volume_molar": 7.639838546162171,
"formula_full": "K4 Co16 P12 O48",
"formula_reduced": "KCo4(PO4)3",
"formula_anonymous": "AB3C4D12",
"energy": -598.07474636,
"energy_per_atom": -7.475934329499999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -538.89074636,
"band_gap": 2.5376000000000003,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 48.0000003,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:29.470000Z",
"spacegroup": 58
},
{
"id": "mp-1224527",
"created_at": "2022-09-04T14:41:53.999376Z",
"structure_string": "Gd1 U1 N2\n1.0\n-2.451079 -2.451079 0.000000\n0.000000 2.451079 -2.451079\n2.482806 -2.482806 -4.933884\nGd U N\n1 1 2\ndirect\n0.250000 0.500000 0.250000 Gd\n0.750000 0.500000 0.750000 U\n0.007314 0.014628 0.978058 N\n0.492686 0.985372 0.521942 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Gd",
"U",
"N"
],
"chemical_system": "Gd-N-U",
"density": 11.818484050733456,
"density_atomic": 0.067256194234124,
"volume": 59.47407589070073,
"volume_molar": 8.954031414618054,
"formula_full": "Gd1 U1 N2",
"formula_reduced": "GdUN2",
"formula_anonymous": "ABC2",
"energy": -48.53257866,
"energy_per_atom": -12.133144665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -47.81057866,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.4159598,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:36.656000Z",
"spacegroup": 166
},
{
"id": "mp-2845",
"created_at": "2022-09-04T14:41:54.002309Z",
"structure_string": "Sb2 Pt2\n1.0\n2.104067 -3.644352 0.000000\n2.104067 3.644352 0.000000\n0.000000 0.000000 5.589409\nSb Pt\n2 2\ndirect\n0.666667 0.333333 0.750000 Sb\n0.333333 0.666667 0.250000 Sb\n0.000000 0.000000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sb",
"Pt"
],
"chemical_system": "Pt-Sb",
"density": 12.275771957890468,
"density_atomic": 0.04666424277791252,
"volume": 85.71873798610766,
"volume_molar": 12.90525764804748,
"formula_full": "Sb2 Pt2",
"formula_reduced": "SbPt",
"formula_anonymous": "AB",
"energy": -22.44600421,
"energy_per_atom": -5.6115010525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.06200421,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0010104,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:32.632000Z",
"spacegroup": 194
},
{
"id": "mp-1217529",
"created_at": "2022-09-04T14:41:54.003199Z",
"structure_string": "Tb1 Ga3 Ni1\n1.0\n4.176289 0.000000 0.000000\n0.000000 4.176289 0.000000\n2.088144 2.088144 5.083355\nTb Ga Ni\n1 3 1\ndirect\n0.990254 0.990254 0.019491 Tb\n0.738484 0.238484 0.523032 Ga\n0.238484 0.738484 0.523032 Ga\n0.403765 0.403765 0.192471 Ga\n0.629013 0.629013 0.741973 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni-Tb",
"density": 7.993362602412352,
"density_atomic": 0.05639472402158014,
"volume": 88.66077610534433,
"volume_molar": 10.678553471944563,
"formula_full": "Tb1 Ga3 Ni1",
"formula_reduced": "TbGa3Ni",
"formula_anonymous": "ABC3",
"energy": -22.41942131,
"energy_per_atom": -4.483884262,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.41942131,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.4e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:40.872000Z",
"spacegroup": 107
},
{
"id": "mp-922",
"created_at": "2022-09-04T14:41:54.008098Z",
"structure_string": "Co1 Pt3\n1.0\n3.889771 0.000000 0.000000\n0.000000 3.889771 0.000000\n0.000000 0.000000 3.889771\nCo Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"Pt"
],
"chemical_system": "Co-Pt",
"density": 18.17555723185693,
"density_atomic": 0.06796540183107062,
"volume": 58.853473859274466,
"volume_molar": 8.860597594888283,
"formula_full": "Co1 Pt3",
"formula_reduced": "CoPt3",
"formula_anonymous": "AB3",
"energy": -25.53692238,
"energy_per_atom": -6.384230595,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.53692238,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.8069703,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:29.587000Z",
"spacegroup": 221
},
{
"id": "mp-1026694",
"created_at": "2022-09-04T14:41:54.010029Z",
"structure_string": "Mg14 Cr1 Si1\n1.0\n6.234622 -0.000000 -0.000000\n-3.117311 5.399340 0.000000\n0.000000 0.000000 10.269543\nMg Cr Si\n14 1 1\ndirect\n0.165539 0.832769 0.125000 Mg\n0.166635 0.833317 0.625000 Mg\n0.667231 0.334461 0.125000 Mg\n0.666683 0.333365 0.625000 Mg\n0.667231 0.832769 0.125000 Mg\n0.666683 0.833317 0.625000 Mg\n0.329912 0.170088 0.375463 Mg\n0.329912 0.170088 0.874537 Mg\n0.329912 0.659825 0.375463 Mg\n0.329912 0.659825 0.874537 Mg\n0.840175 0.170088 0.375463 Mg\n0.840175 0.170088 0.874537 Mg\n0.833333 0.666667 0.376416 Mg\n0.833333 0.666667 0.873584 Mg\n0.166667 0.333333 0.625000 Cr\n0.166667 0.333333 0.125000 Si\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"Si"
],
"chemical_system": "Cr-Mg-Si",
"density": 2.019109539941659,
"density_atomic": 0.04628263335203968,
"volume": 345.7020234414747,
"volume_molar": 13.011664038633628,
"formula_full": "Mg14 Cr1 Si1",
"formula_reduced": "Mg14CrSi",
"formula_anonymous": "ABC14",
"energy": -35.978934980000005,
"energy_per_atom": -2.2486834362500003,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -36.04993498,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.6883788,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:31.040000Z",
"spacegroup": 187
},
{
"id": "mp-13090",
"created_at": "2022-09-04T14:41:54.015086Z",
"structure_string": "Y3 Mg3 Al3\n1.0\n3.682447 -6.378186 0.000000\n3.682447 6.378186 0.000000\n0.000000 0.000000 4.557695\nY Mg Al\n3 3 3\ndirect\n0.000000 0.567094 0.000000 Y\n0.432906 0.432906 0.000000 Y\n0.567094 0.000000 0.000000 Y\n0.758605 0.758605 0.500000 Mg\n0.241395 0.000000 0.500000 Mg\n0.000000 0.241395 0.500000 Mg\n0.666667 0.333333 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.333333 0.666667 0.500000 Al\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Y",
"Mg",
"Al"
],
"chemical_system": "Al-Mg-Y",
"density": 3.262014205984238,
"density_atomic": 0.042037179576977474,
"volume": 214.09619033835077,
"volume_molar": 14.32574882663667,
"formula_full": "Y3 Mg3 Al3",
"formula_reduced": "YMgAl",
"formula_anonymous": "ABC",
"energy": -38.42445872,
"energy_per_atom": -4.269384302222222,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.42445872,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0013491,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:39.188000Z",
"spacegroup": 189
},
{
"id": "mp-1235354",
"created_at": "2022-09-04T14:41:54.025204Z",
"structure_string": "Li1 Tl6 Si2 O7\n1.0\n0.000113 -0.000289 -5.202926\n-8.515846 0.000514 0.000294\n-4.258372 7.372895 0.000449\nLi Tl Si O\n1 6 2 7\ndirect\n0.361583 0.999972 0.000037 Li\n0.726524 0.711267 0.381590 Tl\n0.726578 0.907080 0.711236 Tl\n0.726545 0.381612 0.907259 Tl\n0.194059 0.270521 0.631621 Tl\n0.194044 0.097741 0.270614 Tl\n0.194086 0.631961 0.097644 Tl\n0.213142 0.666679 0.666724 Si\n0.687768 0.333491 0.333275 Si\n0.247316 0.876999 0.605032 O\n0.247346 0.517645 0.877027 O\n0.247372 0.604931 0.518246 O\n0.789051 0.127610 0.391452 O\n0.789027 0.480827 0.127324 O\n0.789222 0.391695 0.480872 O\n0.364837 0.333367 0.333350 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Tl",
"Si",
"O"
],
"chemical_system": "Li-O-Si-Tl",
"density": 7.123857281108754,
"density_atomic": 0.048980321003897424,
"volume": 326.6618035991814,
"volume_molar": 12.295021013685906,
"formula_full": "Li1 Tl6 Si2 O7",
"formula_reduced": "LiTl6Si2O7",
"formula_anonymous": "AB2C6D7",
"energy": -87.88820333,
"energy_per_atom": -5.493012708125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -83.07920333,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.7238418,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:31.296000Z",
"spacegroup": 143
}
]
}