{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=id&page=84","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=id&page=82","results":[{"id":"mp-1016234","created_at":"2022-09-04T14:39:11.969514Z","structure_string":"Mg3 Bi1\n1.0\n3.396224 0.000000 0.000000\n0.000000 5.312505 0.000000\n0.000000 0.000000 5.610981\nMg Bi\n3 1\ndirect\n0.000000 0.000000 0.667755 Mg\n0.000000 0.500000 0.338839 Mg\n0.500000 0.500000 0.827565 Mg\n0.500000 0.000000 0.165842 Bi\n","nsites":4,"nelements":2,"elements":["Mg","Bi"],"chemical_system":"Bi-Mg","density":4.623838001602492,"density_atomic":0.03951168171841057,"volume":101.23588331438168,"volume_molar":15.241418482053547,"formula_full":"Mg3 Bi1","formula_reduced":"Mg3Bi","formula_anonymous":"AB3","energy":-8.80311705,"energy_per_atom":-2.2007792625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.80311705,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0012746,"is_theoretical":true,"updated_at":"2021-11-28T01:34:32.139000Z","spacegroup":25},{"id":"mp-1016235","created_at":"2022-09-04T14:46:42.629756Z","structure_string":"Ca1 Mg3\n1.0\n3.529273 0.000000 0.000000\n0.000000 5.374360 0.000000\n0.000000 0.000000 5.797461\nCa Mg\n1 3\ndirect\n0.000000 0.000000 0.173399 Ca\n0.500000 0.000000 0.663132 Mg\n0.500000 0.500000 0.344011 Mg\n0.000000 0.500000 0.819457 Mg\n","nsites":4,"nelements":2,"elements":["Ca","Mg"],"chemical_system":"Ca-Mg","density":1.7062819370963764,"density_atomic":0.036375598506069674,"volume":109.96382641876134,"volume_molar":16.55544103004969,"formula_full":"Ca1 Mg3","formula_reduced":"CaMg3","formula_anonymous":"AB3","energy":-6.71399218,"energy_per_atom":-1.678498045,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.71399218,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0014398,"is_theoretical":true,"updated_at":"2021-11-28T01:37:38.445000Z","spacegroup":25},{"id":"mp-1016236","created_at":"2022-09-04T14:45:21.761392Z","structure_string":"Mg3 Sb1\n1.0\n3.284526 0.000000 0.000000\n0.000000 5.218539 0.000000\n0.000000 0.000000 5.524087\nMg Sb\n3 1\ndirect\n0.000000 0.000000 0.667539 Mg\n0.000000 0.500000 0.334942 Mg\n0.500000 0.500000 0.831793 Mg\n0.500000 0.000000 0.165726 Sb\n","nsites":4,"nelements":2,"elements":["Mg","Sb"],"chemical_system":"Mg-Sb","density":3.414107043649487,"density_atomic":0.04224524606378806,"volume":94.68521011713872,"volume_molar":14.255191580389637,"formula_full":"Mg3 Sb1","formula_reduced":"Mg3Sb","formula_anonymous":"AB3","energy":-9.36733297,"energy_per_atom":-2.3418332425,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.17533297,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006982,"is_theoretical":true,"updated_at":"2021-11-28T01:37:08.265000Z","spacegroup":25},{"id":"mp-1016237","created_at":"2022-09-04T14:42:46.738718Z","structure_string":"Mg3 Cd1\n1.0\n3.227146 0.000000 0.000000\n0.000000 5.093342 0.000000\n0.000000 0.000000 5.398160\nMg Cd\n3 1\ndirect\n0.000000 0.000000 0.667716 Mg\n0.000000 0.500000 0.332816 Mg\n0.500000 0.500000 0.833587 Mg\n0.500000 0.000000 0.165882 Cd\n","nsites":4,"nelements":2,"elements":["Mg","Cd"],"chemical_system":"Cd-Mg","density":3.4683126868733476,"density_atomic":0.04508092163487711,"volume":88.72933061123084,"volume_molar":13.358512962035224,"formula_full":"Mg3 Cd1","formula_reduced":"Mg3Cd","formula_anonymous":"AB3","energy":-5.92549524,"energy_per_atom":-1.48137381,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.92549524,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0013791,"is_theoretical":true,"updated_at":"2021-11-28T01:35:49.355000Z","spacegroup":25},{"id":"mp-1016238","created_at":"2022-09-04T14:47:27.762899Z","structure_string":"Mg3 Sn1\n1.0\n3.315804 0.000000 0.000000\n0.000000 5.185974 0.000000\n0.000000 0.000000 5.441060\nMg Sn\n3 1\ndirect\n0.000000 0.000000 0.666993 Mg\n0.000000 0.500000 0.333520 Mg\n0.500000 0.500000 0.833172 Mg\n0.500000 0.000000 0.166316 Sn\n","nsites":4,"nelements":2,"elements":["Mg","Sn"],"chemical_system":"Mg-Sn","density":3.400936820662862,"density_atomic":0.042752084032827445,"volume":93.56269034577532,"volume_molar":14.086192278663804,"formula_full":"Mg3 Sn1","formula_reduced":"Mg3Sn","formula_anonymous":"AB3","energy":-9.09055968,"energy_per_atom":-2.27263992,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.09055968,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0012515,"is_theoretical":true,"updated_at":"2021-11-28T01:38:14.040000Z","spacegroup":25},{"id":"mp-1016239","created_at":"2022-09-04T14:39:20.876781Z","structure_string":"Hf1 Mg3\n1.0\n3.025734 0.000000 0.000000\n0.000000 5.089323 0.000000\n0.000000 0.000000 5.793508\nHf Mg\n1 3\ndirect\n0.500000 0.000000 0.159882 Hf\n0.000000 0.000000 0.658085 Mg\n0.000000 0.500000 0.332850 Mg\n0.500000 0.500000 0.849183 Mg\n","nsites":4,"nelements":2,"elements":["Hf","Mg"],"chemical_system":"Hf-Mg","density":4.679405024535391,"density_atomic":0.044836078424123293,"volume":89.21386839772917,"volume_molar":13.431461830881018,"formula_full":"Hf1 Mg3","formula_reduced":"HfMg3","formula_anonymous":"AB3","energy":-14.07139936,"energy_per_atom":-3.51784984,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-14.07139936,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0017549,"is_theoretical":true,"updated_at":"2021-11-28T01:34:43.442000Z","spacegroup":25},{"id":"mp-1016240","created_at":"2022-09-04T14:45:09.409341Z","structure_string":"Mg3 C1\n1.0\n3.895058 0.000000 0.000000\n0.000000 3.895058 0.000000\n0.000000 0.000000 4.969680\nMg C\n3 1\ndirect\n0.500000 0.000000 0.827897 Mg\n0.500000 0.500000 0.301464 Mg\n0.000000 0.500000 0.827897 Mg\n0.000000 0.000000 0.038341 C\n","nsites":4,"nelements":2,"elements":["Mg","C"],"chemical_system":"C-Mg","density":1.8703890422916327,"density_atomic":0.05305223786219868,"volume":75.39738493953561,"volume_molar":11.35134162604469,"formula_full":"Mg3 C1","formula_reduced":"Mg3C","formula_anonymous":"AB3","energy":-11.29187524,"energy_per_atom":-2.82296881,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.29187524,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002901,"is_theoretical":true,"updated_at":"2021-11-28T01:36:52.284000Z","spacegroup":99},{"id":"mp-1016241","created_at":"2022-09-04T14:44:40.820796Z","structure_string":"Mg3 Mn1\n1.0\n3.095143 0.000000 0.000000\n0.000000 4.900468 0.000000\n0.000000 0.000000 5.301453\nMg Mn\n3 1\ndirect\n0.500000 0.000000 0.666154 Mg\n0.500000 0.500000 0.323852 Mg\n0.000000 0.500000 0.842277 Mg\n0.000000 0.000000 0.167716 Mn\n","nsites":4,"nelements":2,"elements":["Mg","Mn"],"chemical_system":"Mg-Mn","density":2.6402617333969762,"density_atomic":0.04974469808600302,"volume":80.41057949702393,"volume_molar":12.106095708106205,"formula_full":"Mg3 Mn1","formula_reduced":"Mg3Mn","formula_anonymous":"AB3","energy":-13.18652851,"energy_per_atom":-3.2966321275,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.18652851,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.7722979,"is_theoretical":true,"updated_at":"2021-11-28T01:37:02.114000Z","spacegroup":25},{"id":"mp-1016242","created_at":"2022-09-04T14:45:42.207522Z","structure_string":"Mg3 Ti1\n1.0\n3.067404 0.000000 0.000000\n0.000000 5.049574 0.000000\n0.000000 0.000000 5.474637\nMg Ti\n3 1\ndirect\n0.000000 0.000000 0.663745 Mg\n0.000000 0.500000 0.323003 Mg\n0.500000 0.500000 0.845957 Mg\n0.500000 0.000000 0.167295 Ti\n","nsites":4,"nelements":2,"elements":["Mg","Ti"],"chemical_system":"Mg-Ti","density":2.365213043359804,"density_atomic":0.047171419183067095,"volume":84.79710954797521,"volume_molar":12.76650324347617,"formula_full":"Mg3 Ti1","formula_reduced":"Mg3Ti","formula_anonymous":"AB3","energy":-11.9861552,"energy_per_atom":-2.9965388,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.9861552,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.581037,"is_theoretical":true,"updated_at":"2021-11-28T01:37:19.060000Z","spacegroup":25},{"id":"mp-1016243","created_at":"2022-09-04T14:45:14.832903Z","structure_string":"Mg3 Zn1\n1.0\n3.094783 0.000000 0.000000\n0.000000 4.995361 0.000000\n0.000000 0.000000 5.298440\nMg Zn\n3 1\ndirect\n0.000000 0.000000 0.667825 Mg\n0.000000 0.500000 0.327622 Mg\n0.500000 0.500000 0.839083 Mg\n0.500000 0.000000 0.165470 Zn\n","nsites":4,"nelements":2,"elements":["Mg","Zn"],"chemical_system":"Mg-Zn","density":2.8041518935389638,"density_atomic":0.04883316682903316,"volume":81.91154208786331,"volume_molar":12.332070908044429,"formula_full":"Mg3 Zn1","formula_reduced":"Mg3Zn","formula_anonymous":"AB3","energy":-6.09025338,"energy_per_atom":-1.522563345,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.09025338,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001857,"is_theoretical":true,"updated_at":"2021-11-28T01:37:00.025000Z","spacegroup":25},{"id":"mp-1016250","created_at":"2022-09-04T14:43:37.516211Z","structure_string":"Mg3 B1\n1.0\n3.284176 0.000000 0.000000\n0.000000 4.290501 0.000000\n0.000000 0.000000 4.922924\nMg B\n3 1\ndirect\n0.000000 0.000000 0.711478 Mg\n0.000000 0.500000 0.306288 Mg\n0.500000 0.500000 0.851326 Mg\n0.500000 0.000000 0.130908 B\n","nsites":4,"nelements":2,"elements":["Mg","B"],"chemical_system":"B-Mg","density":2.0042499388959656,"density_atomic":0.05766368991435873,"volume":69.36774261135112,"volume_molar":10.44355775522516,"formula_full":"Mg3 B1","formula_reduced":"Mg3B","formula_anonymous":"AB3","energy":-9.05177967,"energy_per_atom":-2.2629449175,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-9.05177967,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.15e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:22.318000Z","spacegroup":25},{"id":"mp-1016252","created_at":"2022-09-04T14:40:17.147168Z","structure_string":"Mg7 Ga1\n1.0\n3.161684 -5.476197 0.000000\n3.161684 5.476197 0.000000\n0.000000 0.000000 5.084029\nMg Ga\n7 1\ndirect\n0.833560 0.667119 0.000000 Mg\n0.332881 0.166440 0.000000 Mg\n0.833560 0.166440 0.000000 Mg\n0.498755 0.501245 0.500000 Mg\n0.002490 0.501245 0.500000 Mg\n0.498755 0.997510 0.500000 Mg\n0.000000 0.000000 0.500000 Mg\n0.333333 0.666667 0.000000 Ga\n","nsites":8,"nelements":2,"elements":["Mg","Ga"],"chemical_system":"Ga-Mg","density":2.262391530473917,"density_atomic":0.04544168718309691,"volume":176.04980131494295,"volume_molar":13.252458553607745,"formula_full":"Mg7 Ga1","formula_reduced":"Mg7Ga","formula_anonymous":"AB7","energy":-14.4543366,"energy_per_atom":-1.806792075,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-14.4543366,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0012858,"is_theoretical":true,"updated_at":"2021-11-28T01:35:02.455000Z","spacegroup":187}]}