{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=nsites&page=108","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=nsites&page=106","results":[{"id":"mp-685145","created_at":"2022-09-04T14:47:15.819343Z","structure_string":"B1 N1\n1.0\n0.000000 2.176571 3.498738\n1.255353 0.000000 3.498738\n1.255353 2.176571 0.000000\nB N\n1 1\ndirect\n0.000175 0.999825 0.000175 B\n0.666525 0.333475 0.666525 N\n","nsites":2,"nelements":2,"elements":["B","N"],"chemical_system":"B-N","density":2.155413045529032,"density_atomic":0.10460438123276368,"volume":19.119658052846162,"volume_molar":5.7570636038653555,"formula_full":"B1 N1","formula_reduced":"BN","formula_anonymous":"AB","energy":-17.92598123,"energy_per_atom":-8.962990615,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.56498123,"band_gap":3.2495000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003404,"is_theoretical":false,"updated_at":"2021-11-28T01:38:01.920000Z","spacegroup":42},{"id":"mp-1215893","created_at":"2022-09-04T14:47:19.951003Z","structure_string":"Y1 Sc1\n1.0\n1.739660 -3.013179 0.000000\n1.739660 3.013179 0.000000\n0.000000 0.000000 5.498150\nY Sc\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.333333 0.666667 0.500000 Sc\n","nsites":2,"nelements":2,"elements":["Y","Sc"],"chemical_system":"Sc-Y","density":3.8562905234808573,"density_atomic":0.03469717416670673,"volume":57.641581714717184,"volume_molar":17.35628593575345,"formula_full":"Y1 Sc1","formula_reduced":"YSc","formula_anonymous":"AB","energy":-12.69675883,"energy_per_atom":-6.348379415,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-12.69675883,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.7728538,"is_theoretical":true,"updated_at":"2021-11-28T01:38:02.838000Z","spacegroup":187},{"id":"mp-1220332","created_at":"2022-09-04T14:47:14.385215Z","structure_string":"Nb1 Pd1\n1.0\n4.768674 -1.437047 0.000000\n4.768674 1.437047 0.000000\n4.335617 0.000000 2.451076\nNb Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.500000 0.500000 Pd\n","nsites":2,"nelements":2,"elements":["Nb","Pd"],"chemical_system":"Nb-Pd","density":9.852773463980851,"density_atomic":0.059535309573163685,"volume":33.59350970607073,"volume_molar":10.11524220361921,"formula_full":"Nb1 Pd1","formula_reduced":"NbPd","formula_anonymous":"AB","energy":-15.53236472,"energy_per_atom":-7.76618236,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-15.53236472,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002222,"is_theoretical":true,"updated_at":"2021-11-28T01:38:01.261000Z","spacegroup":166},{"id":"mp-1039170","created_at":"2022-09-04T14:47:10.777935Z","structure_string":"Mg1 Bi1\n1.0\n0.000000 3.058867 3.058867\n3.058867 0.000000 3.058867\n3.058867 3.058867 0.000000\nMg Bi\n1 1\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Bi\n","nsites":2,"nelements":2,"elements":["Mg","Bi"],"chemical_system":"Bi-Mg","density":6.767447242900896,"density_atomic":0.03493962322263373,"volume":57.24160181282119,"volume_molar":17.23584917223402,"formula_full":"Mg1 Bi1","formula_reduced":"MgBi","formula_anonymous":"AB","energy":-5.561755,"energy_per_atom":-2.7808775,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.561755,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.004708,"is_theoretical":true,"updated_at":"2021-11-28T01:37:59.934000Z","spacegroup":225},{"id":"mp-1780","created_at":"2022-09-04T14:47:14.645133Z","structure_string":"Sc1 Rh1\n1.0\n3.236101 0.000000 0.000000\n0.000000 3.236101 0.000000\n0.000000 0.000000 3.236101\nSc Rh\n1 1\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Rh\n","nsites":2,"nelements":2,"elements":["Sc","Rh"],"chemical_system":"Rh-Sc","density":7.244989220960364,"density_atomic":0.05901518769262635,"volume":33.88958127892034,"volume_molar":10.204391437955955,"formula_full":"Sc1 Rh1","formula_reduced":"ScRh","formula_anonymous":"AB","energy":-15.75919918,"energy_per_atom":-7.87959959,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-15.75919918,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0011103,"is_theoretical":false,"updated_at":"2021-11-28T01:37:59.351000Z","spacegroup":221},{"id":"mp-11576","created_at":"2022-09-04T14:47:22.818938Z","structure_string":"Yb1 Tl1\n1.0\n3.859875 0.000000 0.000000\n0.000000 3.859875 0.000000\n0.000000 0.000000 3.859875\nYb Tl\n1 1\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Tl\n","nsites":2,"nelements":2,"elements":["Yb","Tl"],"chemical_system":"Tl-Yb","density":10.898283057935288,"density_atomic":0.03477845413353664,"volume":57.50686883093555,"volume_molar":17.31572293833753,"formula_full":"Yb1 Tl1","formula_reduced":"YbTl","formula_anonymous":"AB","energy":-4.8749214,"energy_per_atom":-2.4374607,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.8749214,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0013793,"is_theoretical":false,"updated_at":"2021-11-28T01:38:07.426000Z","spacegroup":221},{"id":"mp-1060567","created_at":"2022-09-04T14:47:22.338461Z","structure_string":"Ir2\n1.0\n2.280203 0.000000 0.000000\n0.000000 7.194537 0.000000\n0.000000 0.000000 12.242584\nIr\n2\ndirect\n0.000000 0.163992 0.250000 Ir\n0.000000 0.836008 0.750000 Ir\n","nsites":2,"nelements":1,"elements":["Ir"],"chemical_system":"Ir","density":3.1784942655438524,"density_atomic":0.009958193020686377,"volume":200.8396499089097,"volume_molar":60.47423209702877,"formula_full":"Ir2","formula_reduced":"Ir","formula_anonymous":"A","energy":-10.11504374,"energy_per_atom":-5.05752187,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-10.11504374,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.3407752,"is_theoretical":false,"updated_at":"2021-11-28T01:38:08.202000Z","spacegroup":51},{"id":"mp-1224785","created_at":"2022-09-04T14:42:45.335266Z","structure_string":"Ga1 Sb1\n1.0\n-2.753434 2.753434 1.590707\n2.753434 -2.753434 1.590707\n2.753434 2.753434 -1.590707\nGa Sb\n1 1\ndirect\n0.750000 0.250000 0.500000 Ga\n0.000000 0.000000 0.000000 Sb\n","nsites":2,"nelements":2,"elements":["Ga","Sb"],"chemical_system":"Ga-Sb","density":6.591432290455336,"density_atomic":0.04146011194398336,"volume":48.23913651516895,"volume_molar":14.525143511760167,"formula_full":"Ga1 Sb1","formula_reduced":"GaSb","formula_anonymous":"AB","energy":-7.29315239,"energy_per_atom":-3.646576195,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-7.10115239,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":9.7e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:51.348000Z","spacegroup":119},{"id":"mp-1001918","created_at":"2022-09-04T14:42:40.963857Z","structure_string":"Hf1 C1\n1.0\n2.896252 0.000000 0.000000\n0.000000 2.896252 0.000000\n0.000000 0.000000 2.896252\nHf C\n1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500000 0.500000 0.500000 C\n","nsites":2,"nelements":2,"elements":["Hf","C"],"chemical_system":"C-Hf","density":13.020768970250511,"density_atomic":0.0823229558415131,"volume":24.294560120634756,"volume_molar":7.315263037437255,"formula_full":"Hf1 C1","formula_reduced":"HfC","formula_anonymous":"AB","energy":-18.38545672,"energy_per_atom":-9.19272836,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.38545672,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":2.1e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:35:48.613000Z","spacegroup":221},{"id":"mp-1696","created_at":"2022-09-04T14:42:20.846953Z","structure_string":"Cd1 Pd1\n1.0\n3.060705 0.000000 0.000000\n0.000000 3.060705 0.000000\n0.000000 0.000000 3.763233\nCd Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Pd\n","nsites":2,"nelements":2,"elements":["Cd","Pd"],"chemical_system":"Cd-Pd","density":10.307512923921333,"density_atomic":0.0567317187554091,"volume":35.25364723432268,"volume_molar":10.615121297423794,"formula_full":"Cd1 Pd1","formula_reduced":"CdPd","formula_anonymous":"AB","energy":-6.92294239,"energy_per_atom":-3.461471195,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.92294239,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0005472,"is_theoretical":false,"updated_at":"2021-11-28T01:35:50.020000Z","spacegroup":123},{"id":"mp-1060143","created_at":"2022-09-04T14:42:41.871506Z","structure_string":"Sr1 U1\n1.0\n11.430274 -1.720671 0.000000\n11.430274 1.720671 0.000000\n11.171251 0.000000 2.969012\nSr U\n1 1\ndirect\n0.890173 0.890173 0.890173 Sr\n0.647827 0.647827 0.647827 U\n","nsites":2,"nelements":2,"elements":["Sr","U"],"chemical_system":"Sr-U","density":4.6302271517727505,"density_atomic":0.017125117764641352,"volume":116.78751804728891,"volume_molar":35.165543634590705,"formula_full":"Sr1 U1","formula_reduced":"SrU","formula_anonymous":"AB","energy":-9.98930037,"energy_per_atom":-4.994650185,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.98930037,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.865975,"is_theoretical":false,"updated_at":"2021-11-28T01:35:56.268000Z","spacegroup":160},{"id":"mp-1186614","created_at":"2022-09-04T14:42:26.322324Z","structure_string":"Pm1 Nd1\n1.0\n1.836402 -3.180741 0.000000\n1.836402 3.180741 0.000000\n0.000000 0.000000 6.029256\nPm Nd\n1 1\ndirect\n0.666667 0.333333 0.000000 Pm\n0.000000 0.000000 0.500000 Nd\n","nsites":2,"nelements":2,"elements":["Pm","Nd"],"chemical_system":"Nd-Pm","density":6.81899966851447,"density_atomic":0.028394891378415766,"volume":70.4352051693457,"volume_molar":21.208535999463972,"formula_full":"Pm1 Nd1","formula_reduced":"PmNd","formula_anonymous":"AB","energy":-9.46403948,"energy_per_atom":-4.73201974,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.46403948,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0011883,"is_theoretical":true,"updated_at":"2021-11-28T01:35:46.339000Z","spacegroup":187}]}