{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-nsites&page=12189","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-nsites&page=12187","results":[{"id":"mp-1096950","created_at":"2022-09-04T14:45:54.814333Z","structure_string":"Fe1\n1.0\n1.244977 -2.156364 0.000000\n1.244977 2.156364 0.000000\n0.000000 0.000000 2.393789\nFe\n1\ndirect\n0.000000 0.000000 0.000000 Fe\n","nsites":1,"nelements":1,"elements":["Fe"],"chemical_system":"Fe","density":7.214963345850613,"density_atomic":0.07780378702116247,"volume":12.852844807258572,"volume_molar":7.740164059574619,"formula_full":"Fe1","formula_reduced":"Fe","formula_anonymous":"A","energy":-7.99332179,"energy_per_atom":-7.99332179,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-7.99332179,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.4667001,"is_theoretical":true,"updated_at":"2021-11-28T01:37:11.394000Z","spacegroup":191},{"id":"mp-1183694","created_at":"2022-09-04T14:45:58.920184Z","structure_string":"Cs1\n1.0\n-2.685025 2.685025 4.021208\n2.685025 -2.685025 4.021208\n2.685025 2.685025 -4.021208\nCs\n1\ndirect\n0.000000 0.000000 0.000000 Cs\n","nsites":1,"nelements":1,"elements":["Cs"],"chemical_system":"Cs","density":1.9031748818855136,"density_atomic":0.008623564247910042,"volume":115.961332373949,"volume_molar":69.83354662730657,"formula_full":"Cs1","formula_reduced":"Cs","formula_anonymous":"A","energy":-0.85803644,"energy_per_atom":-0.85803644,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-0.85803644,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":5.73e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:37:15.151000Z","spacegroup":139},{"id":"mp-979286","created_at":"2022-09-04T14:46:00.044267Z","structure_string":"Xe1\n1.0\n3.564170 -3.059918 0.000000\n3.564170 3.059918 0.000000\n0.937162 0.000000 4.603057\nXe\n1\ndirect\n0.500000 0.500000 0.500000 Xe\n","nsites":1,"nelements":1,"elements":["Xe"],"chemical_system":"Xe","density":2.17143144245685,"density_atomic":0.009959910887620821,"volume":100.40250472952529,"volume_molar":60.4638016137767,"formula_full":"Xe1","formula_reduced":"Xe","formula_anonymous":"A","energy":-0.03016646,"energy_per_atom":-0.03016646,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-0.03016646,"band_gap":6.1713000000000005,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":7.07e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:37:14.249000Z","spacegroup":166},{"id":"mp-10641","created_at":"2022-09-04T14:46:00.561683Z","structure_string":"Sc1\n1.0\n-1.838692 1.838692 1.838692\n1.838692 -1.838692 1.838692\n1.838692 1.838692 -1.838692\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n","nsites":1,"nelements":1,"elements":["Sc"],"chemical_system":"Sc","density":3.0022645557526153,"density_atomic":0.04021731281916648,"volume":24.86491338932588,"volume_molar":14.974000841572915,"formula_full":"Sc1","formula_reduced":"Sc","formula_anonymous":"A","energy":-6.23023766,"energy_per_atom":-6.23023766,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.23023766,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0707755,"is_theoretical":true,"updated_at":"2021-11-28T01:37:14.804000Z","spacegroup":229},{"id":"mp-1065697","created_at":"2022-09-04T14:45:58.744371Z","structure_string":"O1\n1.0\n2.352226 0.000000 0.000000\n0.000000 2.352226 0.000000\n0.000000 0.000000 1.544743\nO\n1\ndirect\n0.000000 0.000000 0.000000 O\n","nsites":1,"nelements":1,"elements":["O"],"chemical_system":"O","density":3.1084112044634713,"density_atomic":0.11699994887126487,"volume":8.547012282033565,"volume_molar":5.147131103985495,"formula_full":"O1","formula_reduced":"O","formula_anonymous":"A","energy":-3.36863,"energy_per_atom":-3.36863,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-3.36863,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0024843,"is_theoretical":true,"updated_at":"2021-11-28T01:37:19.712000Z","spacegroup":123},{"id":"mp-998861","created_at":"2022-09-04T14:45:58.407954Z","structure_string":"Br1\n1.0\n0.000000 2.362556 2.362556\n2.362556 0.000000 2.362556\n2.362556 2.362556 0.000000\nBr\n1\ndirect\n0.000000 0.000000 0.000000 Br\n","nsites":1,"nelements":1,"elements":["Br"],"chemical_system":"Br","density":5.030849068090698,"density_atomic":0.037916100872080034,"volume":26.374019928203158,"volume_molar":15.882806041468449,"formula_full":"Br1","formula_reduced":"Br","formula_anonymous":"A","energy":-0.97066589,"energy_per_atom":-0.97066589,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-0.97066589,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0652367,"is_theoretical":true,"updated_at":"2021-11-28T01:37:08.184000Z","spacegroup":225},{"id":"mp-568714","created_at":"2022-09-04T14:46:13.922040Z","structure_string":"Bi1\n1.0\n-4.257482 4.257482 1.430564\n4.257482 -4.257482 1.430564\n4.257482 4.257482 -1.430564\nBi\n1\ndirect\n0.000000 0.000000 0.000000 Bi\n","nsites":1,"nelements":1,"elements":["Bi"],"chemical_system":"Bi","density":3.3456594246894324,"density_atomic":0.009641110839802734,"volume":103.72248764857692,"volume_molar":62.46314205970917,"formula_full":"Bi1","formula_reduced":"Bi","formula_anonymous":"A","energy":-2.72344529,"energy_per_atom":-2.72344529,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-2.72344529,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001033,"is_theoretical":false,"updated_at":"2021-11-28T01:37:29.762000Z","spacegroup":139},{"id":"mp-12093","created_at":"2022-09-04T14:46:18.225381Z","structure_string":"Ge1\n1.0\n0.000000 2.141902 2.141902\n2.141902 0.000000 2.141902\n2.141902 2.141902 0.000000\nGe\n1\ndirect\n0.000000 0.000000 0.000000 Ge\n","nsites":1,"nelements":1,"elements":["Ge"],"chemical_system":"Ge","density":6.137565617256281,"density_atomic":0.05088282500499262,"volume":19.652996858996726,"volume_molar":11.835311344071616,"formula_full":"Ge1","formula_reduced":"Ge","formula_anonymous":"A","energy":-4.28899835,"energy_per_atom":-4.28899835,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.28899835,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0087759,"is_theoretical":false,"updated_at":"2021-11-28T01:37:30.602000Z","spacegroup":225},{"id":"mp-135","created_at":"2022-09-04T14:45:03.944801Z","structure_string":"Li1\n1.0\n-1.713409 1.713409 1.713409\n1.713409 -1.713409 1.713409\n1.713409 1.713409 -1.713409\nLi\n1\ndirect\n0.000000 0.000000 0.000000 Li\n","nsites":1,"nelements":1,"elements":["Li"],"chemical_system":"Li","density":0.5728329870110183,"density_atomic":0.04970005591332286,"volume":20.120701709953906,"volume_molar":12.116969788731513,"formula_full":"Li1","formula_reduced":"Li","formula_anonymous":"A","energy":-1.90379596,"energy_per_atom":-1.90379596,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-1.90379596,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001077,"is_theoretical":false,"updated_at":"2021-11-28T01:36:52.373000Z","spacegroup":229},{"id":"mp-632250","created_at":"2022-09-04T14:45:20.751634Z","structure_string":"H1\n1.0\n-2.605000 2.605000 2.605000\n2.605000 -2.605000 2.605000\n2.605000 2.605000 -2.605000\nH\n1\ndirect\n0.000000 0.000000 0.000000 H\n","nsites":1,"nelements":1,"elements":["H"],"chemical_system":"H","density":0.023670127850447698,"density_atomic":0.014142195147712436,"volume":70.7103805,"volume_molar":42.58278645641592,"formula_full":"H1","formula_reduced":"H","formula_anonymous":"A","energy":-1.12145603,"energy_per_atom":-1.12145603,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-1.12145603,"band_gap":7.4222,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.0,"is_theoretical":true,"updated_at":"2021-11-28T01:37:02.478000Z","spacegroup":229},{"id":"mp-8643","created_at":"2022-09-04T14:45:09.701003Z","structure_string":"Os1\n1.0\n0.000000 1.931726 1.931726\n1.931726 0.000000 1.931726\n1.931726 1.931726 0.000000\nOs\n1\ndirect\n0.000000 0.000000 0.000000 Os\n","nsites":1,"nelements":1,"elements":["Os"],"chemical_system":"Os","density":21.910966458732304,"density_atomic":0.06936388805536671,"volume":14.416723572383852,"volume_molar":8.681953865090561,"formula_full":"Os1","formula_reduced":"Os","formula_anonymous":"A","energy":-11.094008,"energy_per_atom":-11.094008,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.094008,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003331,"is_theoretical":true,"updated_at":"2021-11-28T01:36:49.661000Z","spacegroup":225},{"id":"mp-1055908","created_at":"2022-09-04T14:48:20.201921Z","structure_string":"Mn1\n1.0\n-1.399720 1.399720 1.399720\n1.399720 -1.399720 1.399720\n1.399720 1.399720 -1.399720\nMn\n1\ndirect\n0.000000 0.000000 0.000000 Mn\n","nsites":1,"nelements":1,"elements":["Mn"],"chemical_system":"Mn","density":8.316465736956358,"density_atomic":0.0911625583163287,"volume":10.969415717032193,"volume_molar":6.60593655029242,"formula_full":"Mn1","formula_reduced":"Mn","formula_anonymous":"A","energy":-9.01655097,"energy_per_atom":-9.01655097,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.01655097,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.9172939,"is_theoretical":false,"updated_at":"2021-11-28T01:39:06.264000Z","spacegroup":229}]}