{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_magnetic&page=46","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_magnetic&page=44","results":[{"id":"mp-1209179","created_at":"2022-09-04T14:41:33.477882Z","structure_string":"Rb2 Sb2 Cl12\n1.0\n3.319216 6.253979 0.000000\n-3.319216 6.253979 0.000000\n0.000000 2.616192 12.405175\nRb Sb Cl\n2 2 12\ndirect\n0.883871 0.116129 0.750000 Rb\n0.116129 0.883871 0.250000 Rb\n0.500000 0.000000 0.500000 Sb\n0.000000 0.500000 0.000000 Sb\n0.458338 0.701631 0.605542 Cl\n0.541662 0.298369 0.394458 Cl\n0.298369 0.541662 0.894458 Cl\n0.701631 0.458338 0.105542 Cl\n0.371503 0.199167 0.659627 Cl\n0.628497 0.800833 0.340373 Cl\n0.800833 0.628497 0.840373 Cl\n0.199167 0.371503 0.159627 Cl\n0.799553 0.892894 0.039663 Cl\n0.200447 0.107106 0.960337 Cl\n0.107106 0.200447 0.460337 Cl\n0.892894 0.799553 0.539663 Cl\n","nsites":16,"nelements":3,"elements":["Rb","Sb","Cl"],"chemical_system":"Cl-Rb-Sb","density":2.707992831790321,"density_atomic":0.031066702447311974,"volume":515.020866058618,"volume_molar":19.384550935888154,"formula_full":"Rb2 Sb2 Cl12","formula_reduced":"RbSbCl6","formula_anonymous":"ABC6","energy":-56.643222990000005,"energy_per_atom":-3.5402014368750003,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-49.27522299,"band_gap":2.0641,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0003254,"is_theoretical":true,"updated_at":"2021-11-28T01:35:26.316000Z","spacegroup":15},{"id":"mp-1094471","created_at":"2022-09-04T14:41:33.489514Z","structure_string":"Mg1 Zr3\n1.0\n0.000000 3.547163 3.547163\n3.547163 0.000000 3.547163\n3.547163 3.547163 0.000000\nMg Zr\n1 3\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Zr\n0.750000 0.750000 0.750000 Zr\n","nsites":4,"nelements":2,"elements":["Mg","Zr"],"chemical_system":"Mg-Zr","density":5.543172682102002,"density_atomic":0.044811198394696244,"volume":89.26340163385211,"volume_molar":13.438919233886786,"formula_full":"Mg1 Zr3","formula_reduced":"MgZr3","formula_anonymous":"AB3","energy":-26.75862237,"energy_per_atom":-6.6896555925,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.75862237,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0010182,"is_theoretical":true,"updated_at":"2021-11-28T01:35:25.489000Z","spacegroup":225},{"id":"mp-1220861","created_at":"2022-09-04T14:41:33.494864Z","structure_string":"Na1 La6 Ga3 S14\n1.0\n5.120238 -8.868512 0.000000\n5.120238 8.868512 0.000000\n0.000000 0.000000 6.150783\nNa La Ga S\n1 6 3 14\ndirect\n0.000000 0.000000 0.738379 Na\n0.623840 0.765525 0.498781 La\n0.141686 0.376160 0.498781 La\n0.234475 0.858314 0.498781 La\n0.373816 0.233502 0.008110 La\n0.859686 0.626184 0.008110 La\n0.766498 0.140314 0.008110 La\n0.666667 0.333333 0.582873 Ga\n0.333333 0.666667 0.085605 Ga\n0.000000 0.000000 0.233291 Ga\n0.901529 0.419197 0.732765 S\n0.517668 0.098471 0.732765 S\n0.580803 0.482332 0.732765 S\n0.098472 0.579399 0.236783 S\n0.480928 0.901528 0.236783 S\n0.420601 0.519072 0.236783 S\n0.856856 0.091558 0.448137 S\n0.234702 0.143144 0.448137 S\n0.908442 0.765298 0.448137 S\n0.151522 0.909086 0.995535 S\n0.757564 0.848478 0.995535 S\n0.090914 0.242436 0.995535 S\n0.333333 0.666667 0.718068 S\n0.666667 0.333333 0.214972 S\n","nsites":24,"nelements":4,"elements":["Na","La","Ga","S"],"chemical_system":"Ga-La-Na-S","density":4.502124736239473,"density_atomic":0.0429645170376678,"volume":558.6004837191292,"volume_molar":14.016544756502851,"formula_full":"Na1 La6 Ga3 S14","formula_reduced":"NaLa6Ga3S14","formula_anonymous":"AB3C6D14","energy":-144.77511702,"energy_per_atom":-6.0322965425,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-137.73311702,"band_gap":1.9689,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0058435,"is_theoretical":true,"updated_at":"2021-11-28T01:35:24.312000Z","spacegroup":143},{"id":"mp-680063","created_at":"2022-09-04T14:41:34.188620Z","structure_string":"K12 La8 N36 O108\n1.0\n13.733327 0.000000 0.000000\n0.000000 13.733327 0.000000\n0.000000 0.000000 13.733327\nK La N O\n12 8 36 108\ndirect\n0.313224 0.436776 0.875000 K\n0.436776 0.875000 0.313224 K\n0.936776 0.625000 0.686776 K\n0.375000 0.186776 0.563224 K\n0.686776 0.936776 0.625000 K\n0.563224 0.375000 0.186776 K\n0.125000 0.813224 0.063224 K\n0.063224 0.125000 0.813224 K\n0.875000 0.313224 0.436776 K\n0.625000 0.686776 0.936776 K\n0.813224 0.063224 0.125000 K\n0.186776 0.563224 0.375000 K\n0.798202 0.701798 0.298202 La\n0.451798 0.048202 0.951798 La\n0.298202 0.798202 0.701798 La\n0.201798 0.201798 0.201798 La\n0.951798 0.451798 0.048202 La\n0.548202 0.548202 0.548202 La\n0.701798 0.298202 0.798202 La\n0.048202 0.951798 0.451798 La\n0.762254 0.625000 0.512254 N\n0.898878 0.088916 0.360322 N\n0.661084 0.851122 0.389678 N\n0.601122 0.911084 0.860322 N\n0.148878 0.889678 0.838916 N\n0.101122 0.588916 0.139678 N\n0.860322 0.601122 0.911084 N\n0.625000 0.512254 0.762254 N\n0.125000 0.987746 0.237746 N\n0.588916 0.139678 0.101122 N\n0.389678 0.661084 0.851122 N\n0.875000 0.487746 0.262254 N\n0.411084 0.639678 0.398878 N\n0.889678 0.838916 0.148878 N\n0.610322 0.161084 0.648878 N\n0.487746 0.262254 0.875000 N\n0.851122 0.389678 0.661084 N\n0.375000 0.012254 0.737746 N\n0.338916 0.351122 0.110322 N\n0.237746 0.125000 0.987746 N\n0.360322 0.898878 0.088916 N\n0.512254 0.762254 0.625000 N\n0.911084 0.860322 0.601122 N\n0.139678 0.101122 0.588916 N\n0.737746 0.375000 0.012254 N\n0.648878 0.610322 0.161084 N\n0.161084 0.648878 0.610322 N\n0.639678 0.398878 0.411084 N\n0.398878 0.411084 0.639678 N\n0.838916 0.148878 0.889678 N\n0.110322 0.338916 0.351122 N\n0.987746 0.237746 0.125000 N\n0.012254 0.737746 0.375000 N\n0.351122 0.110322 0.338916 N\n0.088916 0.360322 0.898878 N\n0.262254 0.875000 0.487746 N\n0.008791 0.155082 0.157300 O\n0.405082 0.241209 0.907300 O\n0.157300 0.008791 0.155082 O\n0.844918 0.657300 0.491209 O\n0.244823 0.666457 0.573820 O\n0.416457 0.494823 0.676180 O\n0.907300 0.405082 0.241209 O\n0.491209 0.844918 0.657300 O\n0.361190 0.307216 0.189638 O\n0.875000 0.554331 0.195669 O\n0.255177 0.333543 0.073820 O\n0.310362 0.638810 0.807216 O\n0.741209 0.592700 0.594918 O\n0.407300 0.094918 0.758791 O\n0.429803 0.603191 0.908394 O\n0.060362 0.057216 0.611190 O\n0.073820 0.255177 0.333543 O\n0.755177 0.166457 0.926180 O\n0.341606 0.353191 0.679803 O\n0.908394 0.429803 0.603191 O\n0.388810 0.560362 0.442784 O\n0.344918 0.842700 0.508791 O\n0.375000 0.945669 0.804331 O\n0.744823 0.833543 0.426180 O\n0.094918 0.758791 0.407300 O\n0.439638 0.942784 0.111190 O\n0.189638 0.361190 0.307216 O\n0.125000 0.054331 0.304331 O\n0.573820 0.244823 0.666457 O\n0.005177 0.323820 0.916457 O\n0.353191 0.679803 0.341606 O\n0.926180 0.755177 0.166457 O\n0.896809 0.091606 0.929803 O\n0.611190 0.060362 0.057216 O\n0.091606 0.929803 0.896809 O\n0.508791 0.344918 0.842700 O\n0.591606 0.570197 0.103191 O\n0.991209 0.655082 0.342700 O\n0.820197 0.658394 0.853191 O\n0.646809 0.179803 0.158394 O\n0.554331 0.195669 0.875000 O\n0.823820 0.583543 0.994823 O\n0.888810 0.939638 0.557216 O\n0.841606 0.146809 0.320197 O\n0.592700 0.594918 0.741209 O\n0.695669 0.625000 0.445669 O\n0.426180 0.744823 0.833543 O\n0.408394 0.070197 0.396809 O\n0.103191 0.591606 0.570197 O\n0.676180 0.416457 0.494823 O\n0.195669 0.875000 0.554331 O\n0.304331 0.125000 0.054331 O\n0.320197 0.841606 0.146809 O\n0.560362 0.442784 0.388810 O\n0.505177 0.176180 0.083543 O\n0.594918 0.741209 0.592700 O\n0.307216 0.189638 0.361190 O\n0.929803 0.896809 0.091606 O\n0.057216 0.611190 0.060362 O\n0.258791 0.092700 0.905082 O\n0.666457 0.573820 0.244823 O\n0.807216 0.310362 0.638810 O\n0.945669 0.804331 0.375000 O\n0.054331 0.304331 0.125000 O\n0.192784 0.810362 0.861190 O\n0.916457 0.005177 0.323820 O\n0.342700 0.991209 0.655082 O\n0.905082 0.258791 0.092700 O\n0.111190 0.439638 0.942784 O\n0.138810 0.692784 0.689638 O\n0.146809 0.320197 0.841606 O\n0.994823 0.823820 0.583543 O\n0.758791 0.407300 0.094918 O\n0.166457 0.926180 0.755177 O\n0.179803 0.158394 0.646809 O\n0.638810 0.807216 0.310362 O\n0.842700 0.508791 0.344918 O\n0.333543 0.073820 0.255177 O\n0.083543 0.505177 0.176180 O\n0.158394 0.646809 0.179803 O\n0.692784 0.689638 0.138810 O\n0.070197 0.396809 0.408394 O\n0.445669 0.695669 0.625000 O\n0.583543 0.994823 0.823820 O\n0.942784 0.111190 0.439638 O\n0.396809 0.408394 0.070197 O\n0.557216 0.888810 0.939638 O\n0.939638 0.557216 0.888810 O\n0.603191 0.908394 0.429803 O\n0.833543 0.426180 0.744823 O\n0.155082 0.157300 0.008791 O\n0.810362 0.861190 0.192784 O\n0.323820 0.916457 0.005177 O\n0.689638 0.138810 0.692784 O\n0.442784 0.388810 0.560362 O\n0.176180 0.083543 0.505177 O\n0.625000 0.445669 0.695669 O\n0.494823 0.676180 0.416457 O\n0.804331 0.375000 0.945669 O\n0.861190 0.192784 0.810362 O\n0.241209 0.907300 0.405082 O\n0.655082 0.342700 0.991209 O\n0.657300 0.491209 0.844918 O\n0.658394 0.853191 0.820197 O\n0.679803 0.341606 0.353191 O\n0.853191 0.820197 0.658394 O\n0.092700 0.905082 0.258791 O\n0.570197 0.103191 0.591606 O\n","nsites":164,"nelements":4,"elements":["K","La","N","O"],"chemical_system":"K-La-N-O","density":2.444235404762623,"density_atomic":0.06331645115445915,"volume":2590.1641202209116,"volume_molar":9.511178611873104,"formula_full":"K12 La8 N36 O108","formula_reduced":"K3La2(NO3)9","formula_anonymous":"A2B3C9D27","energy":-1131.328756,"energy_per_atom":-6.898346073170733,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-1057.132756,"band_gap":3.466,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0048873,"is_theoretical":false,"updated_at":"2021-11-28T01:35:20.328000Z","spacegroup":213},{"id":"mp-1197394","created_at":"2022-09-04T14:41:32.238237Z","structure_string":"Tb22 Cd90\n1.0\n0.000000 10.908442 10.908442\n10.908442 0.000000 10.908442\n10.908442 10.908442 0.000000\nTb Cd\n22 90\ndirect\n0.000000 0.000000 0.000000 Tb\n0.013637 0.333461 0.639266 Tb\n0.013637 0.013637 0.639266 Tb\n0.333461 0.013637 0.639266 Tb\n0.013637 0.639266 0.333461 Tb\n0.333461 0.639266 0.013637 Tb\n0.013637 0.639266 0.013637 Tb\n0.639266 0.013637 0.013637 Tb\n0.639266 0.333461 0.013637 Tb\n0.639266 0.013637 0.333461 Tb\n0.333461 0.013637 0.013637 Tb\n0.013637 0.013637 0.333461 Tb\n0.013637 0.333461 0.013637 Tb\n0.250000 0.250000 0.250000 Tb\n0.406384 0.406384 0.780848 Tb\n0.406384 0.780848 0.406384 Tb\n0.780848 0.406384 0.406384 Tb\n0.406384 0.406384 0.406384 Tb\n0.662195 0.662195 0.013415 Tb\n0.662195 0.013415 0.662195 Tb\n0.013415 0.662195 0.662195 Tb\n0.662195 0.662195 0.662195 Tb\n0.083347 0.083347 0.749960 Cd\n0.083347 0.749960 0.083347 Cd\n0.749960 0.083347 0.083347 Cd\n0.083347 0.083347 0.083347 Cd\n0.913316 0.913316 0.260053 Cd\n0.913316 0.260053 0.913316 Cd\n0.260053 0.913316 0.913316 Cd\n0.913316 0.913316 0.913316 Cd\n0.156338 0.156338 0.843662 Cd\n0.843662 0.156338 0.843662 Cd\n0.156338 0.843662 0.843662 Cd\n0.843662 0.843662 0.156338 Cd\n0.156338 0.843662 0.156338 Cd\n0.843662 0.156338 0.156338 Cd\n0.390740 0.200774 0.017746 Cd\n0.390740 0.390740 0.017746 Cd\n0.200774 0.390740 0.017746 Cd\n0.390740 0.017746 0.200774 Cd\n0.200774 0.017746 0.390740 Cd\n0.390740 0.017746 0.390740 Cd\n0.017746 0.390740 0.390740 Cd\n0.017746 0.200774 0.390740 Cd\n0.017746 0.390740 0.200774 Cd\n0.200774 0.390740 0.390740 Cd\n0.390740 0.390740 0.200774 Cd\n0.390740 0.200774 0.390740 Cd\n0.163340 0.163340 0.509981 Cd\n0.163340 0.509981 0.163340 Cd\n0.509981 0.163340 0.163340 Cd\n0.163340 0.163340 0.163340 Cd\n0.263223 0.611602 0.861953 Cd\n0.263223 0.263223 0.861953 Cd\n0.611602 0.263223 0.861953 Cd\n0.263223 0.861953 0.611602 Cd\n0.611602 0.861953 0.263223 Cd\n0.263223 0.861953 0.263223 Cd\n0.861953 0.263223 0.263223 Cd\n0.861953 0.611602 0.263223 Cd\n0.861953 0.263223 0.611602 Cd\n0.611602 0.263223 0.263223 Cd\n0.263223 0.263223 0.611602 Cd\n0.263223 0.611602 0.263223 Cd\n0.500000 0.500000 0.500000 Cd\n0.640593 0.450075 0.268739 Cd\n0.640593 0.640593 0.268739 Cd\n0.450075 0.640593 0.268739 Cd\n0.640593 0.268739 0.450075 Cd\n0.450075 0.268739 0.640593 Cd\n0.640593 0.268739 0.640593 Cd\n0.268739 0.640593 0.640593 Cd\n0.268739 0.450075 0.640593 Cd\n0.268739 0.640593 0.450075 Cd\n0.450075 0.640593 0.640593 Cd\n0.640593 0.640593 0.450075 Cd\n0.640593 0.450075 0.640593 Cd\n0.512491 0.833611 0.141406 Cd\n0.512491 0.512491 0.141406 Cd\n0.833611 0.512491 0.141406 Cd\n0.512491 0.141406 0.833611 Cd\n0.833611 0.141406 0.512491 Cd\n0.512491 0.141406 0.512491 Cd\n0.141406 0.512491 0.512491 Cd\n0.141406 0.833611 0.512491 Cd\n0.141406 0.512491 0.833611 Cd\n0.833611 0.512491 0.512491 Cd\n0.512491 0.512491 0.833611 Cd\n0.512491 0.833611 0.512491 Cd\n0.750000 0.750000 0.750000 Cd\n0.830051 0.830051 0.509847 Cd\n0.830051 0.509847 0.830051 Cd\n0.509847 0.830051 0.830051 Cd\n0.830051 0.830051 0.830051 Cd\n0.911590 0.911590 0.588410 Cd\n0.588410 0.911590 0.588410 Cd\n0.911590 0.588410 0.588410 Cd\n0.588410 0.588410 0.911590 Cd\n0.911590 0.588410 0.911590 Cd\n0.588410 0.911590 0.911590 Cd\n0.763960 0.067636 0.404444 Cd\n0.763960 0.763960 0.404444 Cd\n0.067636 0.763960 0.404444 Cd\n0.763960 0.404444 0.067636 Cd\n0.067636 0.404444 0.763960 Cd\n0.763960 0.404444 0.763960 Cd\n0.404444 0.763960 0.763960 Cd\n0.404444 0.067636 0.763960 Cd\n0.404444 0.763960 0.067636 Cd\n0.067636 0.763960 0.763960 Cd\n0.763960 0.763960 0.067636 Cd\n0.763960 0.067636 0.763960 Cd\n","nsites":112,"nelements":2,"elements":["Tb","Cd"],"chemical_system":"Cd-Tb","density":8.707547621920577,"density_atomic":0.043141957483638,"volume":2596.0806262088845,"volume_molar":13.958895495838258,"formula_full":"Tb22 Cd90","formula_reduced":"Tb11Cd45","formula_anonymous":"A11B45","energy":-211.84647213,"energy_per_atom":-1.8914863583035715,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-211.84647213,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.5053458,"is_theoretical":false,"updated_at":"2021-11-28T01:35:22.122000Z","spacegroup":216},{"id":"mp-1096255","created_at":"2022-09-04T14:41:33.604768Z","structure_string":"Hf1 Ni2 Au1\n1.0\n-4.604513 4.967149 7.014206\n4.604513 -4.967149 7.014206\n4.604513 4.967149 -7.014206\nHf Ni Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.000000 0.232797 0.232797 Ni\n0.000000 0.767203 0.767203 Ni\n0.000000 0.500000 0.500000 Au\n","nsites":4,"nelements":3,"elements":["Hf","Ni","Au"],"chemical_system":"Au-Hf-Ni","density":1.275347737590849,"density_atomic":0.006233480314005234,"volume":641.6960988892347,"volume_molar":96.60960581634627,"formula_full":"Hf1 Ni2 Au1","formula_reduced":"HfNi2Au","formula_anonymous":"ABC2","energy":-16.38860411,"energy_per_atom":-4.0971510275,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.38860411,"band_gap":0.2676000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":4.08e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:27.364000Z","spacegroup":71},{"id":"mp-1212482","created_at":"2022-09-04T14:41:33.502058Z","structure_string":"Hf4 Cr8 Si10\n1.0\n-2.464876 3.780469 8.022997\n2.464876 -3.780469 8.022997\n2.464876 3.780469 -8.022997\nHf Cr Si\n4 8 10\ndirect\n0.737786 0.358510 0.379275 Hf\n0.262214 0.641490 0.620725 Hf\n0.979235 0.858510 0.120725 Hf\n0.020765 0.141490 0.879275 Hf\n0.308189 0.558189 0.250000 Cr\n0.691811 0.441811 0.750000 Cr\n0.691811 0.941811 0.250000 Cr\n0.308189 0.058189 0.750000 Cr\n0.314104 0.062287 0.251817 Cr\n0.685896 0.937713 0.748183 Cr\n0.810469 0.562287 0.248183 Cr\n0.189531 0.437713 0.751817 Cr\n0.419439 0.211108 0.208330 Si\n0.580561 0.788892 0.791670 Si\n0.002778 0.711108 0.291670 Si\n0.997222 0.288892 0.708330 Si\n0.000000 0.250000 0.250000 Si\n0.000000 0.750000 0.750000 Si\n0.509543 0.435804 0.073739 Si\n0.490457 0.564196 0.926261 Si\n0.362065 0.935804 0.426261 Si\n0.637935 0.064196 0.573739 Si\n","nsites":22,"nelements":3,"elements":["Hf","Cr","Si"],"chemical_system":"Cr-Hf-Si","density":7.833794648705563,"density_atomic":0.07356738216488878,"volume":299.04557363058996,"volume_molar":8.185884263901624,"formula_full":"Hf4 Cr8 Si10","formula_reduced":"Hf2Cr4Si5","formula_anonymous":"A2B4C5","energy":-182.58208956,"energy_per_atom":-8.299185889090909,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-183.29208956,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0043752,"is_theoretical":true,"updated_at":"2021-11-28T01:35:20.233000Z","spacegroup":72},{"id":"mp-582813","created_at":"2022-09-04T14:41:33.505277Z","structure_string":"K40 In20 Sb36\n1.0\n12.534814 0.000000 0.000000\n0.000000 17.090832 0.000000\n0.000000 9.625096 16.302231\nK In Sb\n40 20 36\ndirect\n0.148846 0.240132 0.327409 K\n0.593724 0.247718 0.322873 K\n0.366855 0.903558 0.035500 K\n0.889924 0.199834 0.610276 K\n0.859773 0.363516 0.965369 K\n0.902874 0.643171 0.524027 K\n0.379599 0.079827 0.466858 K\n0.906276 0.247718 0.822873 K\n0.133811 0.754141 0.786058 K\n0.866189 0.245859 0.213942 K\n0.140227 0.636484 0.034631 K\n0.351154 0.240132 0.827409 K\n0.366189 0.754141 0.286058 K\n0.133145 0.903558 0.535500 K\n0.636415 0.562355 0.857459 K\n0.093724 0.752282 0.177127 K\n0.646882 0.791757 0.395470 K\n0.120401 0.079827 0.966858 K\n0.633811 0.245859 0.713942 K\n0.146882 0.208243 0.104530 K\n0.136415 0.437645 0.642541 K\n0.648846 0.759868 0.172591 K\n0.633145 0.096442 0.964500 K\n0.610076 0.199834 0.110276 K\n0.402874 0.356829 0.975973 K\n0.097126 0.356829 0.475973 K\n0.851154 0.759868 0.672591 K\n0.640227 0.363516 0.465369 K\n0.620401 0.920173 0.533142 K\n0.853118 0.791757 0.895470 K\n0.863585 0.562355 0.357459 K\n0.597126 0.643171 0.024027 K\n0.879599 0.920173 0.033142 K\n0.389924 0.800166 0.889724 K\n0.353118 0.208243 0.604530 K\n0.359773 0.636484 0.534631 K\n0.363585 0.437645 0.142541 K\n0.866855 0.096442 0.464500 K\n0.406276 0.752282 0.677127 K\n0.110076 0.800166 0.389724 K\n0.020283 0.479798 0.228742 In\n0.520283 0.520202 0.271258 In\n0.500996 0.007960 0.306817 In\n0.277633 0.532567 0.776259 In\n0.251018 0.012111 0.810050 In\n0.479717 0.479798 0.728742 In\n0.751018 0.987889 0.689950 In\n0.499004 0.992040 0.693183 In\n0.369279 0.491747 0.447736 In\n0.777633 0.467433 0.723741 In\n0.748982 0.987889 0.189950 In\n0.000996 0.992040 0.193183 In\n0.248982 0.012111 0.310050 In\n0.979717 0.520202 0.771258 In\n0.130721 0.491747 0.947736 In\n0.222367 0.532567 0.276260 In\n0.630721 0.508253 0.552264 In\n0.999004 0.007960 0.806817 In\n0.722367 0.467433 0.223741 In\n0.869279 0.508253 0.052264 In\n0.123646 0.655260 0.647141 Sb\n0.518000 0.962077 0.174605 Sb\n0.122785 0.177297 0.745748 Sb\n0.482000 0.037923 0.825395 Sb\n0.874501 0.900855 0.444259 Sb\n0.166123 0.587501 0.398999 Sb\n0.230423 0.965706 0.177069 Sb\n0.431831 0.398157 0.620826 Sb\n0.568169 0.601843 0.379174 Sb\n0.622785 0.822703 0.754252 Sb\n0.333877 0.587501 0.898999 Sb\n0.931831 0.601843 0.879174 Sb\n0.623646 0.344740 0.852859 Sb\n0.374501 0.099145 0.055741 Sb\n0.861463 0.630519 0.122387 Sb\n0.666123 0.412499 0.101001 Sb\n0.125499 0.099145 0.555741 Sb\n0.833877 0.412499 0.601001 Sb\n0.622733 0.126647 0.554157 Sb\n0.638537 0.630519 0.622387 Sb\n0.068169 0.398157 0.120826 Sb\n0.730423 0.034294 0.322931 Sb\n0.018000 0.037923 0.325395 Sb\n0.377215 0.177297 0.245748 Sb\n0.377267 0.873353 0.445843 Sb\n0.361463 0.369481 0.377613 Sb\n0.877215 0.822703 0.254252 Sb\n0.877267 0.126647 0.054157 Sb\n0.769577 0.034294 0.822931 Sb\n0.876354 0.344740 0.352859 Sb\n0.982000 0.962077 0.674605 Sb\n0.376354 0.655260 0.147141 Sb\n0.138537 0.369481 0.877613 Sb\n0.269577 0.965706 0.677069 Sb\n0.122733 0.873353 0.945843 Sb\n0.625499 0.900855 0.944259 Sb\n","nsites":96,"nelements":3,"elements":["K","In","Sb"],"chemical_system":"In-K-Sb","density":3.919589681063759,"density_atomic":0.027487996773041784,"volume":3492.4334716944445,"volume_molar":21.908256209874395,"formula_full":"K40 In20 Sb36","formula_reduced":"K10In5Sb9","formula_anonymous":"A5B9C10","energy":-291.84762263,"energy_per_atom":-3.040079402395833,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-284.93562263,"band_gap":0.5520999999999998,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.3163117,"is_theoretical":false,"updated_at":"2021-11-28T01:35:26.345000Z","spacegroup":14},{"id":"mp-973662","created_at":"2022-09-04T14:41:32.259980Z","structure_string":"Lu2 Zn1 Cu1\n1.0\n0.000000 3.451773 3.451773\n3.451773 0.000000 3.451773\n3.451773 3.451773 0.000000\nLu Zn Cu\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Lu\n0.750000 0.750000 0.750000 Lu\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Cu\n","nsites":4,"nelements":3,"elements":["Lu","Zn","Cu"],"chemical_system":"Cu-Lu-Zn","density":9.667791625045417,"density_atomic":0.048629892960157795,"volume":82.25393387719727,"volume_molar":12.383619196805363,"formula_full":"Lu2 Zn1 Cu1","formula_reduced":"Lu2ZnCu","formula_anonymous":"ABC2","energy":-15.69339532,"energy_per_atom":-3.92334883,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-15.69339532,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006051,"is_theoretical":true,"updated_at":"2021-11-28T01:35:18.775000Z","spacegroup":225},{"id":"mp-7120","created_at":"2022-09-04T14:41:33.515669Z","structure_string":"Sm1 Al2 Si2\n1.0\n2.112185 -3.658412 0.000000\n2.112185 3.658412 0.000000\n0.000000 0.000000 6.718770\nSm Al Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.666667 0.333333 0.357516 Al\n0.333333 0.666667 0.642484 Al\n0.666667 0.333333 0.734552 Si\n0.333333 0.666667 0.265448 Si\n","nsites":5,"nelements":3,"elements":["Sm","Al","Si"],"chemical_system":"Al-Si-Sm","density":4.165840268525567,"density_atomic":0.048153256993527516,"volume":103.83513623329927,"volume_molar":12.506196124614089,"formula_full":"Sm1 Al2 Si2","formula_reduced":"Sm(AlSi)2","formula_anonymous":"AB2C2","energy":-24.8731827,"energy_per_atom":-4.9746365400000006,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-25.0151827,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.002017,"is_theoretical":false,"updated_at":"2021-11-28T01:35:27.208000Z","spacegroup":164},{"id":"mp-984728","created_at":"2022-09-04T14:41:33.521110Z","structure_string":"B2 C2\n1.0\n1.295834 -2.244451 0.000000\n1.295834 2.244451 0.000000\n0.000000 0.000000 4.657464\nB C\n2 2\ndirect\n0.666667 0.333333 0.519483 B\n0.333333 0.666667 0.019483 B\n0.666667 0.333333 0.855518 C\n0.333333 0.666667 0.355518 C\n","nsites":4,"nelements":2,"elements":["B","C"],"chemical_system":"B-C","density":2.7976158746225206,"density_atomic":0.14764576341998636,"volume":27.09187116071718,"volume_molar":4.078776539540586,"formula_full":"B2 C2","formula_reduced":"BC","formula_anonymous":"AB","energy":-29.81644403,"energy_per_atom":-7.4541110075,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-29.81644403,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.001636,"is_theoretical":true,"updated_at":"2021-11-28T01:35:23.520000Z","spacegroup":186},{"id":"mp-1211636","created_at":"2022-09-04T14:41:34.906940Z","structure_string":"Sm30 Ni56 P42\n1.0\n-0.000000 0.000000 -3.917854\n-12.153672 -21.050778 0.000000\n-12.153673 21.050778 0.000000\nSm Ni P\n30 56 42\ndirect\n0.750000 0.614345 0.757415 Sm\n0.250000 0.385655 0.242585 Sm\n0.750000 0.143069 0.385655 Sm\n0.250000 0.856931 0.614345 Sm\n0.750000 0.242585 0.856931 Sm\n0.250000 0.757415 0.143069 Sm\n0.750000 0.467693 0.584909 Sm\n0.250000 0.532307 0.415091 Sm\n0.750000 0.117217 0.532307 Sm\n0.250000 0.882783 0.467693 Sm\n0.750000 0.415091 0.882783 Sm\n0.250000 0.584909 0.117217 Sm\n0.750000 0.587236 0.908080 Sm\n0.250000 0.412764 0.091920 Sm\n0.750000 0.320843 0.412764 Sm\n0.250000 0.679157 0.587236 Sm\n0.750000 0.091920 0.679157 Sm\n0.250000 0.908080 0.320843 Sm\n0.750000 0.440770 0.733866 Sm\n0.250000 0.559230 0.266134 Sm\n0.750000 0.293096 0.559230 Sm\n0.250000 0.706904 0.440770 Sm\n0.750000 0.266134 0.706904 Sm\n0.250000 0.733866 0.293096 Sm\n0.750000 0.758386 0.930708 Sm\n0.250000 0.241614 0.069292 Sm\n0.750000 0.172322 0.241614 Sm\n0.250000 0.827678 0.758386 Sm\n0.750000 0.069292 0.827678 Sm\n0.250000 0.930708 0.172322 Sm\n0.750000 0.610621 0.629398 Ni\n0.250000 0.389379 0.370602 Ni\n0.750000 0.018777 0.389379 Ni\n0.250000 0.981223 0.610621 Ni\n0.750000 0.370602 0.981223 Ni\n0.250000 0.629398 0.018777 Ni\n0.750000 0.692208 0.185076 Ni\n0.250000 0.307792 0.814924 Ni\n0.750000 0.492868 0.307792 Ni\n0.250000 0.507132 0.692208 Ni\n0.750000 0.814924 0.507132 Ni\n0.250000 0.185076 0.492868 Ni\n0.750000 0.994016 0.537228 Ni\n0.250000 0.005984 0.462772 Ni\n0.750000 0.543212 0.005984 Ni\n0.250000 0.456788 0.994016 Ni\n0.750000 0.462772 0.456788 Ni\n0.250000 0.537228 0.543212 Ni\n0.750000 0.666667 0.333333 Ni\n0.250000 0.333333 0.666667 Ni\n0.750000 0.900145 0.965494 Ni\n0.250000 0.099855 0.034506 Ni\n0.750000 0.065349 0.099855 Ni\n0.250000 0.934651 0.900145 Ni\n0.750000 0.034506 0.934651 Ni\n0.250000 0.965494 0.065349 Ni\n0.750000 0.715637 0.031290 Ni\n0.250000 0.284363 0.968710 Ni\n0.750000 0.315653 0.284363 Ni\n0.250000 0.684347 0.715637 Ni\n0.750000 0.968710 0.684347 Ni\n0.250000 0.031290 0.315653 Ni\n0.750000 0.887964 0.060857 Ni\n0.250000 0.112036 0.939143 Ni\n0.750000 0.172893 0.112036 Ni\n0.250000 0.827107 0.887964 Ni\n0.750000 0.939143 0.827107 Ni\n0.250000 0.060857 0.172893 Ni\n0.750000 0.840448 0.359960 Ni\n0.250000 0.159552 0.640040 Ni\n0.750000 0.519512 0.159552 Ni\n0.250000 0.480488 0.840448 Ni\n0.750000 0.640040 0.480488 Ni\n0.250000 0.359960 0.519512 Ni\n0.750000 0.759750 0.802298 Ni\n0.250000 0.240250 0.197702 Ni\n0.750000 0.042548 0.240250 Ni\n0.250000 0.957452 0.759750 Ni\n0.750000 0.197702 0.957452 Ni\n0.250000 0.802298 0.042548 Ni\n0.750000 0.865359 0.211181 Ni\n0.250000 0.134641 0.788819 Ni\n0.750000 0.345823 0.134641 Ni\n0.250000 0.654177 0.865359 Ni\n0.750000 0.788819 0.654177 Ni\n0.250000 0.211181 0.345823 Ni\n0.750000 0.994948 0.130526 P\n0.250000 0.005052 0.869474 P\n0.750000 0.135578 0.005052 P\n0.250000 0.864422 0.994948 P\n0.750000 0.869474 0.864422 P\n0.250000 0.130526 0.135578 P\n0.750000 0.823487 0.104411 P\n0.250000 0.176513 0.895589 P\n0.750000 0.280924 0.176513 P\n0.250000 0.719076 0.823487 P\n0.750000 0.895589 0.719076 P\n0.250000 0.104411 0.280924 P\n0.750000 0.799585 0.252448 P\n0.250000 0.200415 0.747552 P\n0.750000 0.452863 0.200415 P\n0.250000 0.547137 0.799585 P\n0.750000 0.747552 0.547137 P\n0.250000 0.252448 0.452863 P\n0.750000 0.946571 0.426097 P\n0.250000 0.053429 0.573903 P\n0.750000 0.479526 0.053429 P\n0.250000 0.520474 0.946571 P\n0.750000 0.573903 0.520474 P\n0.250000 0.426097 0.479526 P\n0.750000 0.652028 0.078673 P\n0.250000 0.347972 0.921327 P\n0.750000 0.426646 0.347972 P\n0.250000 0.573354 0.652028 P\n0.750000 0.921327 0.573354 P\n0.250000 0.078673 0.426646 P\n0.750000 0.773533 0.400127 P\n0.250000 0.226467 0.599873 P\n0.750000 0.626594 0.226467 P\n0.250000 0.373406 0.773533 P\n0.750000 0.599873 0.373406 P\n0.250000 0.400127 0.626594 P\n0.750000 0.971172 0.278592 P\n0.250000 0.028828 0.721408 P\n0.750000 0.307420 0.028828 P\n0.250000 0.692580 0.971172 P\n0.750000 0.721408 0.692580 P\n0.250000 0.278592 0.307420 P\n","nsites":128,"nelements":3,"elements":["Sm","Ni","P"],"chemical_system":"Ni-P-Sm","density":7.5364414329499185,"density_atomic":0.06384928605827991,"volume":2004.7209280173474,"volume_molar":9.431805947686167,"formula_full":"Sm30 Ni56 P42","formula_reduced":"Sm15(Ni4P3)7","formula_anonymous":"A15B21C28","energy":-823.91150368,"energy_per_atom":-6.4368086225,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-823.91150368,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0086995,"is_theoretical":true,"updated_at":"2021-11-28T01:35:27.761000Z","spacegroup":176}]}