{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_per_atom&page=10235","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=energy_per_atom&page=10233","results":[{"id":"mp-1235127","created_at":"2022-09-04T14:42:51.913397Z","structure_string":"Li1 P4 Br12 O4\n1.0\n6.668792 0.311456 0.087686\n0.502524 10.313801 -0.110348\n0.146453 -0.114600 10.571486\nLi P Br O\n1 4 12 4\ndirect\n0.818294 0.389955 0.036299 Li\n0.381424 0.310755 0.240808 P\n0.607696 0.684294 0.744809 P\n0.879919 0.192456 0.747246 P\n0.107206 0.815765 0.242759 P\n0.804755 0.642360 0.577537 Br\n0.877235 0.982898 0.249493 Br\n0.294871 0.843410 0.407895 Br\n0.682020 0.167197 0.917123 Br\n0.207659 0.346645 0.433243 Br\n0.809628 0.651969 0.908345 Br\n0.410299 0.526752 0.752256 Br\n0.692029 0.155482 0.586637 Br\n0.112123 0.028330 0.747677 Br\n0.185853 0.336023 0.032159 Br\n0.304948 0.848399 0.078948 Br\n0.618513 0.475188 0.230988 Br\n0.499892 0.816105 0.749194 O\n0.954730 0.322628 0.750671 O\n0.498917 0.180916 0.233961 O\n0.022822 0.688725 0.238348 O\n","nsites":21,"nelements":4,"elements":["Li","P","Br","O"],"chemical_system":"Br-Li-O-P","density":2.6415470104899677,"density_atomic":0.028956265971852274,"volume":725.2316310540048,"volume_molar":20.79736650386478,"formula_full":"Li1 P4 Br12 O4","formula_reduced":"LiP4(Br3O)4","formula_anonymous":"AB4C4D12","energy":-89.21050583,"energy_per_atom":-4.248119325238095,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-80.05450583,"band_gap":0.4401,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.0009033,"is_theoretical":true,"updated_at":"2021-11-28T01:35:50.207000Z","spacegroup":1},{"id":"mp-642331","created_at":"2022-09-04T14:41:49.444127Z","structure_string":"Ca19 In8 N7\n1.0\n0.000000 7.382466 7.382466\n7.382466 0.000000 7.382466\n7.382466 7.382466 0.000000\nCa In N\n19 8 7\ndirect\n0.172996 0.500000 0.827004 Ca\n0.500000 0.827004 0.172996 Ca\n0.827004 0.172996 0.500000 Ca\n0.166548 0.833452 0.166548 Ca\n0.827004 0.500000 0.172996 Ca\n0.172996 0.827004 0.500000 Ca\n0.166548 0.166548 0.833452 Ca\n0.172996 0.500000 0.500000 Ca\n0.833452 0.833452 0.166548 Ca\n0.833452 0.166548 0.833452 Ca\n0.500000 0.827004 0.500000 Ca\n0.500000 0.500000 0.500000 Ca\n0.500000 0.500000 0.172996 Ca\n0.166548 0.833452 0.833452 Ca\n0.500000 0.172996 0.827004 Ca\n0.500000 0.172996 0.500000 Ca\n0.827004 0.500000 0.500000 Ca\n0.833452 0.166548 0.166548 Ca\n0.500000 0.500000 0.827004 Ca\n0.174739 0.174739 0.475782 In\n0.825261 0.524218 0.825261 In\n0.475782 0.174739 0.174739 In\n0.174739 0.475782 0.174739 In\n0.524218 0.825261 0.825261 In\n0.174739 0.174739 0.174739 In\n0.825261 0.825261 0.825261 In\n0.825261 0.825261 0.524218 In\n0.673761 0.326239 0.673761 N\n0.673761 0.326239 0.326239 N\n0.326239 0.673761 0.673761 N\n0.326239 0.673761 0.326239 N\n0.326239 0.326239 0.673761 N\n0.673761 0.673761 0.326239 N\n0.000000 0.000000 0.000000 N\n","nsites":34,"nelements":3,"elements":["Ca","In","N"],"chemical_system":"Ca-In-N","density":3.669140127563676,"density_atomic":0.042251735742421886,"volume":804.7006685659799,"volume_molar":14.253002046383642,"formula_full":"Ca19 In8 N7","formula_reduced":"Ca19In8N7","formula_anonymous":"A7B8C19","energy":-144.43056713,"energy_per_atom":-4.247957856764706,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-141.90356713,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0173166,"is_theoretical":false,"updated_at":"2021-11-28T01:35:25.398000Z","spacegroup":225},{"id":"mp-1206647","created_at":"2022-09-04T14:46:27.377167Z","structure_string":"Ni1 Sn2 Au1\n1.0\n-1.802131 -3.121382 0.000000\n-1.802131 3.121382 0.000000\n0.000000 0.000000 -7.368016\nNi Sn Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ni\n0.333333 0.666667 0.778396 Sn\n0.333333 0.666667 0.221604 Sn\n0.666667 0.333333 0.500000 Au\n","nsites":4,"nelements":3,"elements":["Ni","Sn","Au"],"chemical_system":"Au-Ni-Sn","density":9.877627005718278,"density_atomic":0.04825542627043473,"volume":82.8922322141154,"volume_molar":12.479717257600234,"formula_full":"Ni1 Sn2 Au1","formula_reduced":"NiSn2Au","formula_anonymous":"ABC2","energy":-16.99179328,"energy_per_atom":-4.24794832,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.99179328,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0008245,"is_theoretical":true,"updated_at":"2021-11-28T01:37:40.428000Z","spacegroup":187},{"id":"mp-974729","created_at":"2022-09-04T14:48:13.392341Z","structure_string":"Nd1 Al8 Cu4\n1.0\n-4.450648 4.450648 2.599559\n4.450648 -4.450648 2.599559\n4.450648 4.450648 -2.599559\nNd Al Cu\n1 8 4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.278778 0.500000 0.778778 Al\n0.500000 0.721222 0.221222 Al\n0.651060 0.000000 0.651060 Al\n0.000000 0.348940 0.348940 Al\n0.000000 0.651060 0.651060 Al\n0.348940 0.000000 0.348940 Al\n0.721222 0.500000 0.221222 Al\n0.500000 0.278778 0.778778 Al\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.500000 Cu\n0.500000 0.000000 0.000000 Cu\n0.000000 0.500000 0.000000 Cu\n","nsites":13,"nelements":3,"elements":["Nd","Al","Cu"],"chemical_system":"Al-Cu-Nd","density":4.952313307164638,"density_atomic":0.0631156686283024,"volume":205.9710414629201,"volume_molar":9.54143541671924,"formula_full":"Nd1 Al8 Cu4","formula_reduced":"Nd(Al2Cu)4","formula_anonymous":"AB4C8","energy":-55.22144384,"energy_per_atom":-4.2478033723076924,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-55.22144384,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0121682,"is_theoretical":false,"updated_at":"2021-11-28T01:38:44.034000Z","spacegroup":139},{"id":"mp-14091","created_at":"2022-09-04T14:39:15.918224Z","structure_string":"Al2 Ag2 Se4\n1.0\n-3.021358 3.021358 5.557863\n3.021358 -3.021358 5.557863\n3.021358 3.021358 -5.557863\nAl Ag Se\n2 2 4\ndirect\n0.250000 0.750000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.000000 0.000000 Ag\n0.750000 0.250000 0.500000 Ag\n0.588875 0.625000 0.463875 Se\n0.375000 0.838875 0.963875 Se\n0.161125 0.125000 0.536125 Se\n0.875000 0.411125 0.036125 Se\n","nsites":8,"nelements":3,"elements":["Al","Ag","Se"],"chemical_system":"Ag-Al-Se","density":4.791076152756863,"density_atomic":0.03942010555014637,"volume":202.9421253026121,"volume_molar":15.276825558823598,"formula_full":"Al2 Ag2 Se4","formula_reduced":"AlAgSe2","formula_anonymous":"ABC2","energy":-33.98209028,"energy_per_atom":-4.247761285,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-32.09409028,"band_gap":1.1351999999999998,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0001698,"is_theoretical":false,"updated_at":"2021-11-28T01:34:35.501000Z","spacegroup":122},{"id":"mp-542568","created_at":"2022-09-04T14:42:21.202917Z","structure_string":"Eu1 Ag5\n1.0\n2.863547 -4.959810 0.000000\n2.863547 4.959810 0.000000\n0.000000 0.000000 4.696666\nEu Ag\n1 5\ndirect\n0.000000 0.000000 0.000000 Eu\n0.333333 0.666667 0.000000 Ag\n0.666667 0.333333 0.000000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.500000 Ag\n0.000000 0.500000 0.500000 Ag\n","nsites":6,"nelements":2,"elements":["Eu","Ag"],"chemical_system":"Ag-Eu","density":8.60458179832466,"density_atomic":0.044974073199255504,"volume":133.4101977692188,"volume_molar":13.390249829761226,"formula_full":"Eu1 Ag5","formula_reduced":"EuAg5","formula_anonymous":"AB5","energy":-25.48603699,"energy_per_atom":-4.247672831666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-25.48603699,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":7.3214664,"is_theoretical":false,"updated_at":"2021-11-28T01:35:46.515000Z","spacegroup":191},{"id":"mp-1186745","created_at":"2022-09-04T14:47:56.614033Z","structure_string":"Pr5 Mg1\n1.0\n6.071536 -3.193971 0.000000\n6.071536 3.193971 0.000000\n4.391327 0.000000 5.270792\nPr Mg\n5 1\ndirect\n0.134732 0.865268 0.500000 Pr\n0.500000 0.134732 0.865268 Pr\n0.865268 0.500000 0.134732 Pr\n0.660266 0.660266 0.660266 Pr\n0.339734 0.339734 0.339734 Pr\n0.000000 0.000000 0.000000 Mg\n","nsites":6,"nelements":2,"elements":["Pr","Mg"],"chemical_system":"Mg-Pr","density":5.920355923875324,"density_atomic":0.0293505222708982,"volume":204.4256638645628,"volume_molar":20.518002045814047,"formula_full":"Pr5 Mg1","formula_reduced":"Pr5Mg","formula_anonymous":"AB5","energy":-25.485888110000005,"energy_per_atom":-4.247648018333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-25.485888110000005,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0380995,"is_theoretical":true,"updated_at":"2021-11-28T01:38:23.516000Z","spacegroup":155},{"id":"mp-1113595","created_at":"2022-09-04T14:46:04.211345Z","structure_string":"Cs2 Er1 Ag1 Cl6\n1.0\n0.000000 5.409623 5.409623\n5.409623 0.000000 5.409623\n5.409623 5.409623 0.000000\nCs Er Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.000000 0.000000 0.000000 Er\n0.500000 0.500000 0.500000 Ag\n0.757526 0.242474 0.242474 Cl\n0.242474 0.242474 0.757526 Cl\n0.242474 0.757526 0.757526 Cl\n0.242474 0.757526 0.242474 Cl\n0.757526 0.242474 0.757526 Cl\n0.757526 0.757526 0.242474 Cl\n","nsites":10,"nelements":4,"elements":["Cs","Er","Ag","Cl"],"chemical_system":"Ag-Cl-Cs-Er","density":3.952676965788416,"density_atomic":0.031584136259222,"volume":316.61464217120016,"volume_molar":19.066979418319995,"formula_full":"Cs2 Er1 Ag1 Cl6","formula_reduced":"Cs2ErAgCl6","formula_anonymous":"ABC2D6","energy":-42.473766,"energy_per_atom":-4.2473766,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-38.789766,"band_gap":3.5361,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002833,"is_theoretical":true,"updated_at":"2021-11-28T01:37:22.016000Z","spacegroup":225},{"id":"mp-697593","created_at":"2022-09-04T14:44:24.825536Z","structure_string":"Te28 W4 Cl20 O4\n1.0\n7.780572 0.000000 0.000000\n0.000000 8.361842 0.000000\n0.000000 0.000000 26.851547\nTe W Cl O\n28 4 20 4\ndirect\n0.957133 0.273372 0.068827 Te\n0.912152 0.781351 0.584365 Te\n0.412152 0.781351 0.915635 Te\n0.087848 0.218649 0.415635 Te\n0.042867 0.273372 0.568827 Te\n0.589627 0.060430 0.360037 Te\n0.542867 0.726628 0.568827 Te\n0.542867 0.273372 0.931173 Te\n0.089627 0.060430 0.139963 Te\n0.912152 0.218649 0.915635 Te\n0.910373 0.939570 0.860037 Te\n0.457133 0.273372 0.431173 Te\n0.957133 0.726628 0.431173 Te\n0.587848 0.781351 0.415635 Te\n0.587848 0.218649 0.084365 Te\n0.410373 0.939570 0.639963 Te\n0.410373 0.060430 0.860037 Te\n0.042867 0.726628 0.931173 Te\n0.457133 0.726628 0.068827 Te\n0.500000 0.000000 0.500000 Te\n0.589627 0.939570 0.139963 Te\n0.089627 0.939570 0.360037 Te\n0.412152 0.218649 0.584365 Te\n0.087848 0.781351 0.084365 Te\n0.000000 0.000000 0.000000 Te\n0.910373 0.060430 0.639963 Te\n0.000000 0.000000 0.500000 Te\n0.500000 0.000000 0.000000 Te\n0.777083 0.500000 0.250000 W\n0.222917 0.500000 0.750000 W\n0.722917 0.500000 0.750000 W\n0.277083 0.500000 0.250000 W\n0.738992 0.554609 0.838045 Cl\n0.758522 0.782493 0.266503 Cl\n0.241478 0.217507 0.733497 Cl\n0.750000 0.515063 0.000000 Cl\n0.261008 0.554609 0.338045 Cl\n0.258522 0.782493 0.233497 Cl\n0.738992 0.445391 0.661955 Cl\n0.238992 0.445391 0.838045 Cl\n0.250000 0.515063 0.500000 Cl\n0.741478 0.217507 0.766503 Cl\n0.750000 0.484937 0.500000 Cl\n0.761008 0.554609 0.161955 Cl\n0.758522 0.217507 0.233497 Cl\n0.761008 0.445391 0.338045 Cl\n0.261008 0.445391 0.161955 Cl\n0.241478 0.782493 0.766503 Cl\n0.741478 0.782493 0.733497 Cl\n0.250000 0.484937 0.000000 Cl\n0.258522 0.217507 0.266503 Cl\n0.238992 0.554609 0.661955 Cl\n0.983351 0.500000 0.750000 O\n0.516649 0.500000 0.250000 O\n0.016649 0.500000 0.250000 O\n0.483351 0.500000 0.750000 O\n","nsites":56,"nelements":4,"elements":["Te","W","Cl","O"],"chemical_system":"Cl-O-Te-W","density":4.82985503948039,"density_atomic":0.0320556975725479,"volume":1746.9593314343504,"volume_molar":18.78649106409491,"formula_full":"Te28 W4 Cl20 O4","formula_reduced":"Te7WCl5O","formula_anonymous":"ABC5D7","energy":-237.84789746,"energy_per_atom":-4.247283883214286,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-205.06789746,"band_gap":0.3680000000000003,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0247366,"is_theoretical":false,"updated_at":"2021-11-28T01:36:31.065000Z","spacegroup":54},{"id":"mp-1245353","created_at":"2022-09-04T14:46:12.650357Z","structure_string":"K56 V8 N32\n1.0\n12.838188 0.000000 0.000000\n0.000000 12.838188 0.000000\n0.000000 0.000000 12.838188\nK V N\n56 8 32\ndirect\n0.375137 0.624863 0.124863 K\n0.624863 0.124863 0.375137 K\n0.124863 0.375137 0.624863 K\n0.875137 0.875137 0.875137 K\n0.624863 0.375137 0.875137 K\n0.375137 0.875137 0.624863 K\n0.875137 0.624863 0.375137 K\n0.124863 0.124863 0.124863 K\n0.356851 0.584711 0.372633 K\n0.643149 0.084711 0.127367 K\n0.143149 0.415289 0.872633 K\n0.856851 0.915289 0.627367 K\n0.372633 0.356851 0.584711 K\n0.127367 0.643149 0.084711 K\n0.872633 0.143149 0.415289 K\n0.627367 0.856851 0.915289 K\n0.584711 0.372633 0.356851 K\n0.084711 0.127367 0.643149 K\n0.415289 0.872633 0.143149 K\n0.915289 0.627367 0.856851 K\n0.643149 0.415289 0.627367 K\n0.356851 0.915289 0.872633 K\n0.856851 0.584711 0.127367 K\n0.143149 0.084711 0.372633 K\n0.627367 0.643149 0.415289 K\n0.872633 0.356851 0.915289 K\n0.127367 0.856851 0.584711 K\n0.372633 0.143149 0.084711 K\n0.415289 0.627367 0.643149 K\n0.915289 0.872633 0.356851 K\n0.584711 0.127367 0.856851 K\n0.084711 0.372633 0.143149 K\n0.420981 0.825050 0.376262 K\n0.579019 0.325050 0.123738 K\n0.079019 0.174950 0.876262 K\n0.920981 0.674950 0.623738 K\n0.376262 0.420981 0.825050 K\n0.123738 0.579019 0.325050 K\n0.876262 0.079019 0.174950 K\n0.623738 0.920981 0.674950 K\n0.825050 0.376262 0.420981 K\n0.325050 0.123738 0.579019 K\n0.174950 0.876262 0.079019 K\n0.674950 0.623738 0.920981 K\n0.579019 0.174950 0.623738 K\n0.420981 0.674950 0.876262 K\n0.920981 0.825050 0.123738 K\n0.079019 0.325050 0.376262 K\n0.623738 0.579019 0.174950 K\n0.876262 0.420981 0.674950 K\n0.123738 0.920981 0.825050 K\n0.376262 0.079019 0.325050 K\n0.174950 0.623738 0.579019 K\n0.674950 0.876262 0.420981 K\n0.825050 0.123738 0.920981 K\n0.325050 0.376262 0.079019 K\n0.162477 0.837523 0.337523 V\n0.837523 0.337523 0.162477 V\n0.337523 0.162477 0.837523 V\n0.662477 0.662477 0.662477 V\n0.837523 0.162477 0.662477 V\n0.162477 0.662477 0.837523 V\n0.662477 0.837523 0.162477 V\n0.337523 0.337523 0.337523 V\n0.246181 0.753819 0.253819 N\n0.753819 0.253819 0.246181 N\n0.253819 0.246181 0.753819 N\n0.746181 0.746181 0.746181 N\n0.753819 0.246181 0.746181 N\n0.246181 0.746181 0.753819 N\n0.746181 0.753819 0.246181 N\n0.253819 0.253819 0.253819 N\n0.082833 0.930993 0.254698 N\n0.917167 0.430993 0.245302 N\n0.417167 0.069007 0.754698 N\n0.582833 0.569007 0.745302 N\n0.254698 0.082833 0.930993 N\n0.245302 0.917167 0.430993 N\n0.754698 0.417167 0.069007 N\n0.745302 0.582833 0.569007 N\n0.930993 0.254698 0.082833 N\n0.430993 0.245302 0.917167 N\n0.069007 0.754698 0.417167 N\n0.569007 0.745302 0.582833 N\n0.917167 0.069007 0.745302 N\n0.082833 0.569007 0.754698 N\n0.582833 0.930993 0.245302 N\n0.417167 0.430993 0.254698 N\n0.745302 0.917167 0.069007 N\n0.754698 0.082833 0.569007 N\n0.245302 0.582833 0.930993 N\n0.254698 0.417167 0.430993 N\n0.069007 0.745302 0.917167 N\n0.569007 0.754698 0.082833 N\n0.930993 0.245302 0.582833 N\n0.430993 0.254698 0.417167 N\n","nsites":96,"nelements":3,"elements":["K","V","N"],"chemical_system":"K-N-V","density":2.389797085274794,"density_atomic":0.04536908699920241,"volume":2115.978221066862,"volume_molar":13.273665304540666,"formula_full":"K56 V8 N32","formula_reduced":"K7VN4","formula_anonymous":"AB4C7","energy":-407.73578941,"energy_per_atom":-4.247247806354166,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-396.18378941,"band_gap":0.2169000000000001,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0267555,"is_theoretical":true,"updated_at":"2021-11-28T01:37:30.432000Z","spacegroup":205},{"id":"mp-1238842","created_at":"2022-09-04T14:43:10.176421Z","structure_string":"As3\n1.0\n-2.035705 2.035705 4.072261\n2.035705 -2.035705 4.072261\n2.035705 2.035705 -4.072261\nAs\n3\ndirect\n0.750000 0.250000 0.500000 As\n0.250000 0.750000 0.500000 As\n0.500000 0.500000 0.000000 As\n","nsites":3,"nelements":1,"elements":["As"],"chemical_system":"As","density":5.529070308698897,"density_atomic":0.04444224320146404,"volume":67.50334330336351,"volume_molar":13.550487838115282,"formula_full":"As3","formula_reduced":"As","formula_anonymous":"A","energy":-12.74168177,"energy_per_atom":-4.247227256666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-12.74168177,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001561,"is_theoretical":true,"updated_at":"2021-11-28T01:36:01.112000Z","spacegroup":139},{"id":"mp-1190212","created_at":"2022-09-04T14:42:12.048360Z","structure_string":"Yb10 Pt6\n1.0\n4.201762 -7.277666 0.000000\n4.201762 7.277666 0.000000\n0.000000 0.000000 6.277145\nYb Pt\n10 6\ndirect\n0.666667 0.333333 0.000000 Yb\n0.333333 0.666667 0.000000 Yb\n0.333333 0.666667 0.500000 Yb\n0.666667 0.333333 0.500000 Yb\n0.735161 0.735161 0.750000 Yb\n0.264839 0.000000 0.750000 Yb\n0.000000 0.264839 0.750000 Yb\n0.264839 0.264839 0.250000 Yb\n0.735161 0.000000 0.250000 Yb\n0.000000 0.735161 0.250000 Yb\n0.389035 0.389035 0.750000 Pt\n0.610965 0.000000 0.750000 Pt\n0.000000 0.610965 0.750000 Pt\n0.610965 0.610965 0.250000 Pt\n0.389035 0.000000 0.250000 Pt\n0.000000 0.389035 0.250000 Pt\n","nsites":16,"nelements":2,"elements":["Yb","Pt"],"chemical_system":"Pt-Yb","density":12.547775172077865,"density_atomic":0.04167774919112089,"volume":383.8978906137444,"volume_molar":14.44929459214407,"formula_full":"Yb10 Pt6","formula_reduced":"Yb5Pt3","formula_anonymous":"A3B5","energy":-67.95536833,"energy_per_atom":-4.247210520625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-67.95536833,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001076,"is_theoretical":false,"updated_at":"2021-11-28T01:35:40.946000Z","spacegroup":193}]}