{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-chemical_system&page=12185","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-chemical_system&page=12183","results":[{"id":"mp-1187170","created_at":"2022-09-04T14:44:53.250333Z","structure_string":"Sr1 Ac1 Ga2\n1.0\n0.000000 3.931399 3.931399\n3.931399 0.000000 3.931399\n3.931399 3.931399 0.000000\nSr Ac Ga\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Ac\n0.750000 0.750000 0.750000 Ga\n0.250000 0.250000 0.250000 Ga\n","nsites":4,"nelements":3,"elements":["Sr","Ac","Ga"],"chemical_system":"Ac-Ga-Sr","density":6.204356107913191,"density_atomic":0.03291460344525335,"volume":121.52660464687581,"volume_molar":18.296257981708905,"formula_full":"Sr1 Ac1 Ga2","formula_reduced":"SrAcGa2","formula_anonymous":"ABC2","energy":-13.4525122,"energy_per_atom":-3.36312805,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.4525122,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0009779,"is_theoretical":true,"updated_at":"2021-11-28T01:36:42.068000Z","spacegroup":225},{"id":"mp-1183054","created_at":"2022-09-04T14:47:56.452882Z","structure_string":"Ac2 Ga1 Si1\n1.0\n0.000000 3.888966 3.888966\n3.888966 0.000000 3.888966\n3.888966 3.888966 0.000000\nAc Ga Si\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ac\n0.250000 0.250000 0.250000 Ac\n0.500000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Si\n","nsites":4,"nelements":3,"elements":["Ac","Ga","Si"],"chemical_system":"Ac-Ga-Si","density":7.7894187033594156,"density_atomic":0.034003808122867143,"volume":117.63388340349002,"volume_molar":17.71019510003112,"formula_full":"Ac2 Ga1 Si1","formula_reduced":"Ac2GaSi","formula_anonymous":"ABC2","energy":-18.07300591,"energy_per_atom":-4.5182514775,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-18.14400591,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.000523,"is_theoretical":true,"updated_at":"2021-11-28T01:38:22.346000Z","spacegroup":225},{"id":"mp-1183053","created_at":"2022-09-04T14:43:54.994972Z","structure_string":"Ac1 Ga1 O3\n1.0\n3.977450 0.000000 0.000000\n0.000000 3.977450 0.000000\n0.000000 0.000000 3.977450\nAc Ga O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.500000 0.500000 0.500000 Ga\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Ac","Ga","O"],"chemical_system":"Ac-Ga-O","density":9.097098637430856,"density_atomic":0.07946132776450215,"volume":62.923690563268636,"volume_molar":7.578706434213749,"formula_full":"Ac1 Ga1 O3","formula_reduced":"AcGaO3","formula_anonymous":"ABC3","energy":-37.30941713,"energy_per_atom":-7.461883426,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-35.24841713,"band_gap":2.895900000000001,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":8e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:36:39.233000Z","spacegroup":221},{"id":"mp-1183074","created_at":"2022-09-04T14:46:29.037463Z","structure_string":"Ac2 Mg1 Ga1\n1.0\n0.000000 4.010121 4.010121\n4.010121 0.000000 4.010121\n4.010121 4.010121 0.000000\nAc Mg Ga\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ac\n0.250000 0.250000 0.250000 Ac\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Ga\n","nsites":4,"nelements":3,"elements":["Ac","Mg","Ga"],"chemical_system":"Ac-Ga-Mg","density":7.055851286179444,"density_atomic":0.031013984425382463,"volume":128.974076504866,"volume_molar":19.417501077582795,"formula_full":"Ac2 Mg1 Ga1","formula_reduced":"Ac2MgGa","formula_anonymous":"ABC2","energy":-13.81627708,"energy_per_atom":-3.45406927,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.81627708,"band_gap":0.2016,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0026135,"is_theoretical":true,"updated_at":"2021-11-28T01:37:36.766000Z","spacegroup":225},{"id":"mp-862613","created_at":"2022-09-04T14:42:22.605532Z","structure_string":"Li1 Ac2 Ga1\n1.0\n0.000000 3.951104 3.951104\n3.951104 0.000000 3.951104\n3.951104 3.951104 0.000000\nLi Ac Ga\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Ac\n0.750000 0.750000 0.750000 Ac\n0.500000 0.500000 0.500000 Ga\n","nsites":4,"nelements":3,"elements":["Li","Ac","Ga"],"chemical_system":"Ac-Ga-Li","density":7.143044314127426,"density_atomic":0.032424598864410306,"volume":123.36312984863034,"volume_molar":18.572753313565233,"formula_full":"Li1 Ac2 Ga1","formula_reduced":"LiAc2Ga","formula_anonymous":"ABC2","energy":-14.03540532,"energy_per_atom":-3.50885133,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-14.03540532,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.00048,"is_theoretical":true,"updated_at":"2021-11-28T01:35:49.147000Z","spacegroup":225},{"id":"mp-1183377","created_at":"2022-09-04T14:40:57.629474Z","structure_string":"Ac2 In1 Ga1\n1.0\n0.000000 4.039104 4.039104\n4.039104 0.000000 4.039104\n4.039104 4.039104 0.000000\nAc In Ga\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ac\n0.250000 0.250000 0.250000 Ac\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Ga\n","nsites":4,"nelements":3,"elements":["Ac","In","Ga"],"chemical_system":"Ac-Ga-In","density":8.045495252419967,"density_atomic":0.03035113166467208,"volume":131.7908025372212,"volume_molar":19.84156909381278,"formula_full":"Ac2 In1 Ga1","formula_reduced":"Ac2InGa","formula_anonymous":"ABC2","energy":-15.60809668,"energy_per_atom":-3.90202417,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-15.60809668,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0983653,"is_theoretical":true,"updated_at":"2021-11-28T01:35:21.172000Z","spacegroup":225},{"id":"mp-867815","created_at":"2022-09-04T14:43:59.786173Z","structure_string":"Ac2 Ga6\n1.0\n3.420561 -5.924586 0.000000\n3.420561 5.924586 0.000000\n0.000000 0.000000 4.704987\nAc Ga\n2 6\ndirect\n0.333333 0.666667 0.750000 Ac\n0.666667 0.333333 0.250000 Ac\n0.135606 0.271211 0.250000 Ga\n0.728789 0.864394 0.250000 Ga\n0.135606 0.864394 0.250000 Ga\n0.864394 0.728789 0.750000 Ga\n0.271211 0.135606 0.750000 Ga\n0.864394 0.135606 0.750000 Ga\n","nsites":8,"nelements":2,"elements":["Ac","Ga"],"chemical_system":"Ac-Ga","density":7.596090276375485,"density_atomic":0.041951376540569255,"volume":190.69696061733674,"volume_molar":14.35504924177223,"formula_full":"Ac2 Ga6","formula_reduced":"AcGa3","formula_anonymous":"AB3","energy":-30.66552448,"energy_per_atom":-3.83319056,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-30.66552448,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0005709,"is_theoretical":true,"updated_at":"2021-11-28T01:36:07.355000Z","spacegroup":194},{"id":"mp-36526","created_at":"2022-09-04T14:46:53.951712Z","structure_string":"Ac1 O1 F1\n1.0\n0.000000 2.987920 2.987920\n2.987920 0.000000 2.987920\n2.987920 2.987920 0.000000\nAc O F\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ac\n0.250000 0.250000 0.250000 O\n0.750000 0.750000 0.750000 F\n","nsites":3,"nelements":3,"elements":["Ac","O","F"],"chemical_system":"Ac-F-O","density":8.1547350603966,"density_atomic":0.05623210783988715,"volume":53.35030314961817,"volume_molar":10.709434505189066,"formula_full":"Ac1 O1 F1","formula_reduced":"AcOF","formula_anonymous":"ABC","energy":-23.46123549,"energy_per_atom":-7.82041183,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.31223549,"band_gap":4.256600000000001,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":7.73e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:37:40.925000Z","spacegroup":216},{"id":"mp-861502","created_at":"2022-09-04T14:41:26.021085Z","structure_string":"Ac1 Fe1 O3\n1.0\n4.014353 0.000000 0.000000\n0.000000 4.014353 0.000000\n0.000000 0.000000 4.014353\nAc Fe O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.500000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Ac","Fe","O"],"chemical_system":"Ac-Fe-O","density":8.492286403675113,"density_atomic":0.07729000341376097,"volume":64.69141906014956,"volume_molar":7.791616630887352,"formula_full":"Ac1 Fe1 O3","formula_reduced":"AcFeO3","formula_anonymous":"ABC3","energy":-41.29277656,"energy_per_atom":-8.258555312,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.97577656,"band_gap":0.9887999999999996,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":5.0000711,"is_theoretical":true,"updated_at":"2021-11-28T01:35:20.013000Z","spacegroup":221},{"id":"mp-977360","created_at":"2022-09-04T14:48:17.511314Z","structure_string":"Ac1 F3\n1.0\n0.000000 3.021662 3.021662\n3.021662 0.000000 3.021662\n3.021662 3.021662 0.000000\nAc F\n1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.250000 0.250000 0.250000 F\n0.750000 0.750000 0.750000 F\n0.500000 0.500000 0.500000 F\n","nsites":4,"nelements":2,"elements":["Ac","F"],"chemical_system":"Ac-F","density":8.546582069007446,"density_atomic":0.07249237806050848,"volume":55.17821468984298,"volume_molar":8.307274393693353,"formula_full":"Ac1 F3","formula_reduced":"AcF3","formula_anonymous":"AB3","energy":-27.49798723,"energy_per_atom":-6.8744968075,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.11198723,"band_gap":7.4101,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":4.11e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:38:49.250000Z","spacegroup":225},{"id":"mp-985278","created_at":"2022-09-04T14:44:19.956369Z","structure_string":"Ac1 F3\n1.0\n-2.003344 2.003344 3.446736\n2.003344 -2.003344 3.446736\n2.003344 2.003344 -3.446736\nAc F\n1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.750000 0.250000 0.500000 F\n0.250000 0.750000 0.500000 F\n0.500000 0.500000 0.000000 F\n","nsites":4,"nelements":2,"elements":["Ac","F"],"chemical_system":"Ac-F","density":8.522775348689388,"density_atomic":0.07229044870960037,"volume":55.33234433318421,"volume_molar":8.33047915388059,"formula_full":"Ac1 F3","formula_reduced":"AcF3","formula_anonymous":"AB3","energy":-27.51722717,"energy_per_atom":-6.8793067925,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.13122717,"band_gap":6.162600000000001,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":7.4e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:36:33.482000Z","spacegroup":139},{"id":"mp-1183124","created_at":"2022-09-04T14:45:41.110944Z","structure_string":"Ac1 Eu1 Zn2\n1.0\n0.000000 3.872601 3.872601\n3.872601 0.000000 3.872601\n3.872601 3.872601 0.000000\nAc Eu Zn\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ac\n0.000000 0.000000 0.000000 Eu\n0.250000 0.250000 0.250000 Zn\n0.750000 0.750000 0.750000 Zn\n","nsites":4,"nelements":3,"elements":["Ac","Eu","Zn"],"chemical_system":"Ac-Eu-Zn","density":7.287781425009125,"density_atomic":0.03443671654525668,"volume":116.15509262455979,"volume_molar":17.48755794439842,"formula_full":"Ac1 Eu1 Zn2","formula_reduced":"AcEuZn2","formula_anonymous":"ABC2","energy":-17.97555775,"energy_per_atom":-4.4938894375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-17.97555775,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":7.0725771,"is_theoretical":true,"updated_at":"2021-11-28T01:37:16.427000Z","spacegroup":225}]}