{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=volume&page=23","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=volume&page=21","results":[{"id":"mp-1224976","created_at":"2022-09-04T14:48:12.839614Z","structure_string":"Fe1 Ni1\n1.0\n4.194995 -1.257932 0.000000\n4.194995 1.257932 0.000000\n3.817784 0.000000 2.145902\nFe Ni\n1 1\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Ni\n","nsites":2,"nelements":2,"elements":["Fe","Ni"],"chemical_system":"Fe-Ni","density":8.397919682739822,"density_atomic":0.08830829562506698,"volume":22.647928893243012,"volume_molar":6.819450785879022,"formula_full":"Fe1 Ni1","formula_reduced":"FeNi","formula_anonymous":"AB","energy":-14.24730989,"energy_per_atom":-7.123654945,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-14.24730989,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.1659732,"is_theoretical":true,"updated_at":"2021-11-28T01:38:45.726000Z","spacegroup":166},{"id":"mp-7755","created_at":"2022-09-04T14:48:18.313900Z","structure_string":"Se1\n1.0\n2.829635 0.000000 0.000000\n0.000000 2.829635 0.000000\n0.000000 0.000000 2.829635\nSe\n1\ndirect\n0.000000 0.000000 0.000000 Se\n","nsites":1,"nelements":1,"elements":["Se"],"chemical_system":"Se","density":5.787153223762264,"density_atomic":0.044137602995476075,"volume":22.656418385531627,"volume_molar":13.64401406351234,"formula_full":"Se1","formula_reduced":"Se","formula_anonymous":"A","energy":-3.31467609,"energy_per_atom":-3.31467609,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-3.31467609,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":4.26e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:38:56.168000Z","spacegroup":221},{"id":"mp-1056351","created_at":"2022-09-04T14:46:26.270611Z","structure_string":"Mg1\n1.0\n-1.825264 1.825264 1.700467\n1.825264 -1.825264 1.700467\n1.825264 1.825264 -1.700467\nMg\n1\ndirect\n0.000000 0.000000 0.000000 Mg\n","nsites":1,"nelements":1,"elements":["Mg"],"chemical_system":"Mg","density":1.7810050334772547,"density_atomic":0.04412862789374627,"volume":22.661026361567792,"volume_molar":13.646789051543191,"formula_full":"Mg1","formula_reduced":"Mg","formula_anonymous":"A","energy":-1.57155674,"energy_per_atom":-1.57155674,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-1.57155674,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.002651,"is_theoretical":false,"updated_at":"2021-11-28T01:37:37.534000Z","spacegroup":139},{"id":"mp-13175","created_at":"2022-09-04T14:43:08.012741Z","structure_string":"Pt1 N1\n1.0\n0.000000 2.246424 2.246424\n2.246424 0.000000 2.246424\n2.246424 2.246424 0.000000\nPt N\n1 1\ndirect\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 N\n","nsites":2,"nelements":2,"elements":["Pt","N"],"chemical_system":"N-Pt","density":15.31364684449444,"density_atomic":0.08821141913853169,"volume":22.672801543517835,"volume_molar":6.826940115930483,"formula_full":"Pt1 N1","formula_reduced":"PtN","formula_anonymous":"AB","energy":-11.99882363,"energy_per_atom":-5.999411815,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.63782363,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0148569,"is_theoretical":true,"updated_at":"2021-11-28T01:36:06.063000Z","spacegroup":225},{"id":"mp-1009601","created_at":"2022-09-04T14:40:15.916502Z","structure_string":"Pd1 N1\n1.0\n1.508369 -2.612571 0.000000\n1.508369 2.612571 0.000000\n0.000000 0.000000 2.879205\nPd N\n1 1\ndirect\n0.666667 0.333333 0.000000 Pd\n0.000000 0.000000 0.500000 N\n","nsites":2,"nelements":2,"elements":["Pd","N"],"chemical_system":"N-Pd","density":8.812387782457836,"density_atomic":0.0881356703721102,"volume":22.69228782802659,"volume_molar":6.832807573340539,"formula_full":"Pd1 N1","formula_reduced":"PdN","formula_anonymous":"AB","energy":-11.23825131,"energy_per_atom":-5.619125655,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-10.87725131,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0068461,"is_theoretical":true,"updated_at":"2021-11-28T01:34:52.949000Z","spacegroup":187},{"id":"mp-11274","created_at":"2022-09-04T14:46:54.641381Z","structure_string":"Be1 Pd1\n1.0\n2.832204 0.000000 0.000000\n0.000000 2.832204 0.000000\n0.000000 0.000000 2.832204\nBe Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.500000 Pd\n","nsites":2,"nelements":2,"elements":["Be","Pd"],"chemical_system":"Be-Pd","density":8.437278937378421,"density_atomic":0.08803520912363087,"volume":22.718183098666024,"volume_molar":6.840604821580988,"formula_full":"Be1 Pd1","formula_reduced":"BePd","formula_anonymous":"AB","energy":-10.10471632,"energy_per_atom":-5.05235816,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-10.10471632,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":4.26e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:37:46.258000Z","spacegroup":221},{"id":"mp-1221647","created_at":"2022-09-04T14:39:07.137195Z","structure_string":"Mn1 Cr1\n1.0\n1.414325 -2.017123 0.000000\n1.414325 2.017123 0.000000\n0.000000 0.000000 3.984864\nMn Cr\n1 1\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Cr\n","nsites":2,"nelements":2,"elements":["Mn","Cr"],"chemical_system":"Cr-Mn","density":7.80980876609525,"density_atomic":0.08796398515060026,"volume":22.736577891234298,"volume_molar":6.846143623085846,"formula_full":"Mn1 Cr1","formula_reduced":"MnCr","formula_anonymous":"AB","energy":-18.68134768,"energy_per_atom":-9.34067384,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.68134768,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.8870883,"is_theoretical":true,"updated_at":"2021-11-28T01:34:41.586000Z","spacegroup":65},{"id":"mp-850274","created_at":"2022-09-04T14:41:05.696555Z","structure_string":"H2\n1.0\n-1.820480 1.820480 1.719522\n1.820480 -1.820480 1.719522\n1.820480 1.820480 -1.719522\nH\n2\ndirect\n0.109061 0.109061 0.000000 H\n0.890939 0.890939 0.000000 H\n","nsites":2,"nelements":1,"elements":["H"],"chemical_system":"H","density":0.1468500914916668,"density_atomic":0.08773854811668441,"volume":22.794997671265076,"volume_molar":6.8637342300115245,"formula_full":"H2","formula_reduced":"H","formula_anonymous":"A","energy":-6.77839157,"energy_per_atom":-3.389195785,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.77839157,"band_gap":8.5338,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:08.080000Z","spacegroup":139},{"id":"mp-585","created_at":"2022-09-04T14:42:40.102201Z","structure_string":"Mn1 B2\n1.0\n1.494491 -2.588535 0.000000\n1.494491 2.588535 0.000000\n0.000000 0.000000 2.947510\nMn B\n1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.666667 0.333333 0.500000 B\n0.333333 0.666667 0.500000 B\n","nsites":3,"nelements":2,"elements":["Mn","B"],"chemical_system":"B-Mn","density":5.574663392752981,"density_atomic":0.13154932570525202,"volume":22.805133997583287,"volume_molar":4.577857566136935,"formula_full":"Mn1 B2","formula_reduced":"MnB2","formula_anonymous":"AB2","energy":-23.39250355,"energy_per_atom":-7.797501183333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-23.39250355,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.8187605,"is_theoretical":false,"updated_at":"2021-11-28T01:36:06.564000Z","spacegroup":191},{"id":"mp-1226211","created_at":"2022-09-04T14:42:46.302857Z","structure_string":"Cr1 Fe1\n1.0\n1.461548 -1.940539 0.000000\n1.461548 1.940539 0.000000\n0.000000 0.000000 4.022967\nCr Fe\n1 1\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Fe\n","nsites":2,"nelements":2,"elements":["Cr","Fe"],"chemical_system":"Cr-Fe","density":7.847322162324531,"density_atomic":0.08764316882323556,"volume":22.819804747518088,"volume_molar":6.871203815263509,"formula_full":"Cr1 Fe1","formula_reduced":"CrFe","formula_anonymous":"AB","energy":-17.93740134,"energy_per_atom":-8.96870067,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.93740134,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.8983687,"is_theoretical":true,"updated_at":"2021-11-28T01:35:51.484000Z","spacegroup":65},{"id":"mp-1056702","created_at":"2022-09-04T14:44:07.550735Z","structure_string":"Mg1\n1.0\n0.000000 2.252800 2.252800\n2.252800 0.000000 2.252800\n2.252800 2.252800 0.000000\nMg\n1\ndirect\n0.000000 0.000000 0.000000 Mg\n","nsites":1,"nelements":1,"elements":["Mg"],"chemical_system":"Mg","density":1.765008555285139,"density_atomic":0.04373227717014831,"volume":22.866405883904,"volume_molar":13.770471490816211,"formula_full":"Mg1","formula_reduced":"Mg","formula_anonymous":"A","energy":-1.60028005,"energy_per_atom":-1.60028005,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-1.60028005,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0007357,"is_theoretical":true,"updated_at":"2021-11-28T01:36:33.591000Z","spacegroup":225},{"id":"mp-47","created_at":"2022-09-04T14:45:28.425709Z","structure_string":"C4\n1.0\n1.256547 -2.176403 0.000000\n1.256547 2.176403 0.000000\n0.000000 0.000000 4.181402\nC\n4\ndirect\n0.333333 0.666667 0.062772 C\n0.666667 0.333333 0.562772 C\n0.666667 0.333333 0.937228 C\n0.333333 0.666667 0.437228 C\n","nsites":4,"nelements":1,"elements":["C"],"chemical_system":"C","density":3.4882486627781524,"density_atomic":0.17490008459449727,"volume":22.87020048774664,"volume_molar":3.443189163665773,"formula_full":"C4","formula_reduced":"C","formula_anonymous":"A","energy":-36.26105525,"energy_per_atom":-9.0652638125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.26105525,"band_gap":3.3394999999999992,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":false,"updated_at":"2021-11-28T01:36:59.546000Z","spacegroup":194}]}