{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_stable&page=3","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_stable","results":[{"id":"mp-1022593","created_at":"2022-09-04T14:39:25.081483Z","structure_string":"Na2 Mg12 Zn2\n1.0\n5.166071 0.000000 0.000000\n0.000000 6.390302 0.000000\n0.000000 0.000000 10.953940\nNa Mg Zn\n2 12 2\ndirect\n0.500000 0.500000 0.169273 Na\n0.500000 0.000000 0.669273 Na\n0.000000 0.247121 0.082672 Mg\n0.000000 0.752879 0.082672 Mg\n0.000000 0.500000 0.833286 Mg\n0.500000 0.245317 0.915729 Mg\n0.500000 0.754683 0.915729 Mg\n0.500000 0.500000 0.665602 Mg\n0.000000 0.747121 0.582672 Mg\n0.000000 0.252879 0.582672 Mg\n0.000000 0.000000 0.333286 Mg\n0.500000 0.745317 0.415729 Mg\n0.500000 0.254683 0.415729 Mg\n0.500000 0.000000 0.165602 Mg\n0.000000 0.500000 0.335038 Zn\n0.000000 0.000000 0.835038 Zn\n","nsites":16,"nelements":3,"elements":["Na","Mg","Zn"],"chemical_system":"Mg-Na-Zn","density":2.1511327795387842,"density_atomic":0.04424537407981168,"volume":361.61972483583304,"volume_molar":13.610780528461591,"formula_full":"Na2 Mg12 Zn2","formula_reduced":"NaMg6Zn","formula_anonymous":"ABC6","energy":-23.58338923,"energy_per_atom":-1.473961826875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-23.58338923,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0047623,"is_theoretical":true,"updated_at":"2021-11-28T01:34:35.072000Z","spacegroup":38},{"id":"mp-1189367","created_at":"2022-09-04T14:39:25.089285Z","structure_string":"Nd1 P12 Ru4\n1.0\n-4.050135 4.050135 4.050135\n4.050135 -4.050135 4.050135\n4.050135 4.050135 -4.050135\nNd P Ru\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.357668 0.214049 0.856381 P\n0.642332 0.785951 0.143619 P\n0.642332 0.498713 0.856381 P\n0.357668 0.501287 0.143619 P\n0.214049 0.856381 0.357668 P\n0.785951 0.143619 0.642332 P\n0.498713 0.856381 0.642332 P\n0.501287 0.143619 0.357668 P\n0.856381 0.357668 0.214049 P\n0.143619 0.642332 0.785951 P\n0.856381 0.642332 0.498713 P\n0.143619 0.357668 0.501287 P\n0.000000 0.000000 0.500000 Ru\n0.500000 0.000000 0.000000 Ru\n0.000000 0.500000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n","nsites":17,"nelements":3,"elements":["Nd","P","Ru"],"chemical_system":"Nd-P-Ru","density":5.749978335023382,"density_atomic":0.06397060111405418,"volume":265.7470729357449,"volume_molar":9.41391929280613,"formula_full":"Nd1 P12 Ru4","formula_reduced":"Nd(P3Ru)4","formula_anonymous":"AB4C12","energy":-117.99660778,"energy_per_atom":-6.940976928235294,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-117.99660778,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002684,"is_theoretical":false,"updated_at":"2021-11-28T01:34:40.756000Z","spacegroup":204},{"id":"mp-1187158","created_at":"2022-09-04T14:39:25.090922Z","structure_string":"Sr2 Br4\n1.0\n7.166314 0.000000 0.000000\n0.000000 7.166314 0.000000\n0.000000 0.000000 4.715678\nSr Br\n2 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.303883 0.303883 0.000000 Br\n0.696117 0.696117 0.000000 Br\n0.196117 0.803883 0.500000 Br\n0.803883 0.196117 0.500000 Br\n","nsites":6,"nelements":2,"elements":["Sr","Br"],"chemical_system":"Br-Sr","density":3.393064602908686,"density_atomic":0.02477510142774989,"volume":242.1786250804031,"volume_molar":24.307229488290893,"formula_full":"Sr2 Br4","formula_reduced":"SrBr2","formula_anonymous":"AB2","energy":-24.86518802,"energy_per_atom":-4.144198003333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.72918802,"band_gap":4.386,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":4.29e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:34:31.812000Z","spacegroup":136},{"id":"mp-28349","created_at":"2022-09-04T14:39:25.092427Z","structure_string":"H16 N8 O16\n1.0\n7.014443 0.000000 0.000000\n0.000000 4.867236 0.000000\n0.000000 1.993902 10.874067\nH N O\n16 8 16\ndirect\n0.449925 0.540942 0.143659 H\n0.949925 0.459058 0.356341 H\n0.550075 0.459058 0.856341 H\n0.050075 0.540942 0.643659 H\n0.571949 0.738947 0.342377 H\n0.071949 0.261053 0.157623 H\n0.428051 0.261053 0.657623 H\n0.928051 0.738947 0.842377 H\n0.370689 0.533344 0.365878 H\n0.870689 0.466656 0.134122 H\n0.629311 0.466656 0.634122 H\n0.129311 0.533344 0.865878 H\n0.376385 0.818896 0.250224 H\n0.876385 0.181104 0.249776 H\n0.623615 0.181104 0.749776 H\n0.123615 0.818896 0.750224 H\n0.249912 0.943288 0.525534 N\n0.749912 0.056712 0.974466 N\n0.750088 0.056712 0.474466 N\n0.250088 0.943288 0.025534 N\n0.043431 0.655210 0.801109 N\n0.543431 0.344790 0.698891 N\n0.956569 0.344790 0.198891 N\n0.456569 0.655210 0.301109 N\n0.531292 0.488170 0.219315 O\n0.031292 0.511830 0.280685 O\n0.468708 0.511830 0.780685 O\n0.968708 0.488170 0.719315 O\n0.175826 0.083663 0.931363 O\n0.675826 0.916337 0.568637 O\n0.824174 0.916337 0.068637 O\n0.324174 0.083663 0.431363 O\n0.302837 0.692112 0.026015 O\n0.802837 0.307888 0.473985 O\n0.697163 0.307888 0.973985 O\n0.197163 0.692112 0.526015 O\n0.272983 0.048908 0.122683 O\n0.772983 0.951092 0.377317 O\n0.727017 0.951092 0.877317 O\n0.227017 0.048908 0.622683 O\n","nsites":40,"nelements":3,"elements":["H","N","O"],"chemical_system":"H-N-O","density":1.7183282144909273,"density_atomic":0.10774382559518166,"volume":371.2509721929608,"volume_molar":5.589314029582139,"formula_full":"H16 N8 O16","formula_reduced":"H2NO2","formula_anonymous":"AB2C2","energy":-229.6738474,"energy_per_atom":-5.741846185,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-218.6818474,"band_gap":3.3779,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0046667,"is_theoretical":false,"updated_at":"2021-11-28T01:34:36.538000Z","spacegroup":14},{"id":"mp-1245987","created_at":"2022-09-04T14:39:25.093189Z","structure_string":"Cs4 Mn4 N4\n1.0\n11.355208 0.000000 0.000000\n0.000000 3.632887 0.000000\n0.000000 0.000000 7.045255\nCs Mn N\n4 4 4\ndirect\n0.667300 0.250000 0.067364 Cs\n0.167300 0.250000 0.432636 Cs\n0.332700 0.750000 0.932636 Cs\n0.832700 0.750000 0.567364 Cs\n0.536183 0.250000 0.591083 Mn\n0.036183 0.250000 0.908917 Mn\n0.463817 0.750000 0.408917 Mn\n0.963817 0.750000 0.091083 Mn\n0.947206 0.250000 0.136195 N\n0.447206 0.250000 0.363805 N\n0.052794 0.750000 0.863805 N\n0.552794 0.750000 0.636195 N\n","nsites":12,"nelements":3,"elements":["Cs","Mn","N"],"chemical_system":"Cs-Mn-N","density":4.613118025172292,"density_atomic":0.041289302452517794,"volume":290.6321804249383,"volume_molar":14.585232499205794,"formula_full":"Cs4 Mn4 N4","formula_reduced":"CsMnN","formula_anonymous":"ABC","energy":-75.27125828,"energy_per_atom":-6.272604856666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-73.82725828,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.1374291,"is_theoretical":true,"updated_at":"2021-11-28T01:34:29.733000Z","spacegroup":62},{"id":"mp-1191780","created_at":"2022-09-04T14:39:25.099396Z","structure_string":"Er6 Ga2 Ni2 S14\n1.0\n4.739687 -8.209379 0.000000\n4.739687 8.209379 0.000000\n0.000000 0.000000 6.162966\nEr Ga Ni S\n6 2 2 14\ndirect\n0.843266 0.624685 0.677773 Er\n0.781419 0.156734 0.677773 Er\n0.375315 0.218581 0.677773 Er\n0.156734 0.375315 0.177773 Er\n0.218581 0.843266 0.177773 Er\n0.624685 0.781419 0.177773 Er\n0.333333 0.666667 0.606046 Ga\n0.666667 0.333333 0.106046 Ga\n0.000000 0.000000 0.006349 Ni\n0.000000 0.000000 0.506349 Ni\n0.565228 0.480067 0.945191 S\n0.914839 0.434772 0.945191 S\n0.519933 0.085161 0.945191 S\n0.434772 0.519933 0.445191 S\n0.085161 0.565228 0.445191 S\n0.480067 0.914839 0.445191 S\n0.333333 0.666667 0.973528 S\n0.666667 0.333333 0.473528 S\n0.130810 0.897757 0.770891 S\n0.766947 0.869190 0.770891 S\n0.102243 0.233053 0.770891 S\n0.869190 0.102243 0.270891 S\n0.233053 0.130810 0.270891 S\n0.897757 0.766947 0.270891 S\n","nsites":24,"nelements":4,"elements":["Er","Ga","Ni","S"],"chemical_system":"Er-Ga-Ni-S","density":5.918161887902813,"density_atomic":0.05004163668952217,"volume":479.6006203575107,"volume_molar":12.034260184901045,"formula_full":"Er6 Ga2 Ni2 S14","formula_reduced":"Er3GaNiS7","formula_anonymous":"ABC3D7","energy":-144.74427488,"energy_per_atom":-6.031011453333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-137.70227488,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0011551,"is_theoretical":false,"updated_at":"2021-11-28T01:34:31.769000Z","spacegroup":173},{"id":"mp-1186605","created_at":"2022-09-04T14:39:25.104813Z","structure_string":"Pm2 Lu6\n1.0\n3.573082 -6.188759 0.000000\n3.573082 6.188759 0.000000\n0.000000 0.000000 5.613924\nPm Lu\n2 6\ndirect\n0.666667 0.333333 0.250000 Pm\n0.333333 0.666667 0.750000 Pm\n0.835644 0.164356 0.750000 Lu\n0.328712 0.164356 0.750000 Lu\n0.835644 0.671288 0.750000 Lu\n0.164356 0.835644 0.250000 Lu\n0.671288 0.835644 0.250000 Lu\n0.164356 0.328712 0.250000 Lu\n","nsites":8,"nelements":2,"elements":["Pm","Lu"],"chemical_system":"Lu-Pm","density":8.960797036109716,"density_atomic":0.03222158563243944,"volume":248.2807671620577,"volume_molar":18.689771598133717,"formula_full":"Pm2 Lu6","formula_reduced":"PmLu3","formula_anonymous":"AB3","energy":-36.57286038,"energy_per_atom":-4.5716075475,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.57286038,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.3377701,"is_theoretical":true,"updated_at":"2021-11-28T01:34:36.839000Z","spacegroup":194},{"id":"mp-10502","created_at":"2022-09-04T14:39:25.110181Z","structure_string":"Ba2 Ce4 Mn2 S10\n1.0\n-3.934532 3.934532 6.810274\n3.934532 -3.934532 6.810274\n3.934532 3.934532 -6.810274\nBa Ce Mn S\n2 4 2 10\ndirect\n0.750000 0.750000 0.000000 Ba\n0.250000 0.250000 0.000000 Ba\n0.841335 0.658665 0.500000 Ce\n0.658665 0.158665 0.817330 Ce\n0.341335 0.841335 0.182670 Ce\n0.158665 0.341335 0.500000 Ce\n0.250000 0.750000 0.500000 Mn\n0.750000 0.250000 0.500000 Mn\n0.982716 0.482716 0.198027 S\n0.715312 0.215312 0.198027 S\n0.017284 0.517284 0.801973 S\n0.517284 0.715312 0.500000 S\n0.215312 0.017284 0.500000 S\n0.482716 0.284688 0.500000 S\n0.784688 0.982716 0.500000 S\n0.284688 0.784688 0.801973 S\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.000000 S\n","nsites":18,"nelements":4,"elements":["Ba","Ce","Mn","S"],"chemical_system":"Ba-Ce-Mn-S","density":4.983677750055958,"density_atomic":0.04268367109638201,"volume":421.70693236191045,"volume_molar":14.108769478617909,"formula_full":"Ba2 Ce4 Mn2 S10","formula_reduced":"BaCe2MnS5","formula_anonymous":"ABC2D5","energy":-123.73706798,"energy_per_atom":-6.874281554444445,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-118.70706798,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":12.9416898,"is_theoretical":false,"updated_at":"2021-11-28T01:34:41.621000Z","spacegroup":140},{"id":"mp-30146","created_at":"2022-09-04T14:39:25.127161Z","structure_string":"Ca2 Sn4 F12\n1.0\n4.495780 0.000000 0.000000\n-0.334773 7.355292 0.000000\n-1.954731 -1.604738 9.647241\nCa Sn F\n2 4 12\ndirect\n0.400626 0.254142 0.053449 Ca\n0.599374 0.745858 0.946551 Ca\n0.361517 0.788790 0.268113 Sn\n0.638483 0.211210 0.731887 Sn\n0.980227 0.725661 0.633587 Sn\n0.019773 0.274339 0.366413 Sn\n0.908262 0.438708 0.612261 F\n0.091738 0.561292 0.387739 F\n0.054729 0.734935 0.854981 F\n0.945271 0.265065 0.145019 F\n0.897112 0.789510 0.176161 F\n0.102888 0.210490 0.823839 F\n0.612960 0.042686 0.891985 F\n0.387040 0.957314 0.108015 F\n0.530535 0.308958 0.305364 F\n0.469465 0.691042 0.694636 F\n0.637073 0.424806 0.898510 F\n0.362927 0.575194 0.101490 F\n","nsites":18,"nelements":3,"elements":["Ca","Sn","F"],"chemical_system":"Ca-F-Sn","density":4.075584624912455,"density_atomic":0.05642406974447934,"volume":319.0127915535756,"volume_molar":10.672999638756506,"formula_full":"Ca2 Sn4 F12","formula_reduced":"CaSn2F6","formula_anonymous":"AB2C6","energy":-99.08555476,"energy_per_atom":-5.504753042222222,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-93.54155476,"band_gap":3.4998000000000005,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001337,"is_theoretical":false,"updated_at":"2021-11-28T01:34:24.982000Z","spacegroup":2},{"id":"mp-1209697","created_at":"2022-09-04T14:39:25.131288Z","structure_string":"Rb2 Co2 Br6 O12\n1.0\n-3.111205 -5.536067 -0.524965\n-3.111205 5.536067 -0.524965\n-0.931940 0.000000 -14.198072\nRb Co Br O\n2 2 6 12\ndirect\n0.390059 0.609941 0.750000 Rb\n0.609941 0.390059 0.250000 Rb\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.500000 0.500000 0.000000 Br\n0.500000 0.500000 0.500000 Br\n0.497454 0.069284 0.874157 Br\n0.502546 0.930716 0.125843 Br\n0.930716 0.502546 0.625843 Br\n0.069284 0.497454 0.374157 Br\n0.869641 0.946709 0.896551 O\n0.130359 0.053290 0.103449 O\n0.053290 0.130359 0.603449 O\n0.946709 0.869641 0.396551 O\n0.190419 0.866591 0.948390 O\n0.809581 0.133409 0.051610 O\n0.133409 0.809581 0.551610 O\n0.866591 0.190419 0.448390 O\n0.676790 0.767073 0.566767 O\n0.323210 0.232927 0.433233 O\n0.232927 0.323210 0.933233 O\n0.767073 0.676790 0.066767 O\n","nsites":22,"nelements":4,"elements":["Rb","Co","Br","O"],"chemical_system":"Br-Co-O-Rb","density":3.2966040794504843,"density_atomic":0.04548520693628969,"volume":483.67373662419527,"volume_molar":13.239778744845777,"formula_full":"Rb2 Co2 Br6 O12","formula_reduced":"RbCo(BrO2)3","formula_anonymous":"ABC3D6","energy":-95.02938827999998,"energy_per_atom":-4.319517649090908,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-83.50938828,"band_gap":0.1938999999999999,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0000003,"is_theoretical":true,"updated_at":"2021-11-28T01:34:41.437000Z","spacegroup":15},{"id":"mp-1221529","created_at":"2022-09-04T14:39:25.132011Z","structure_string":"Mn2 Zn2 S8\n1.0\n5.725862 0.000000 0.000000\n0.000000 5.715813 0.000000\n0.000000 0.043384 5.741799\nMn Zn S\n2 2 8\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.000000 Zn\n0.595893 0.095186 0.126815 S\n0.095893 0.404814 0.873185 S\n0.376503 0.624777 0.412315 S\n0.876503 0.875223 0.587685 S\n0.404107 0.904814 0.873185 S\n0.904107 0.595186 0.126815 S\n0.623497 0.375223 0.587685 S\n0.123497 0.124777 0.412315 S\n","nsites":12,"nelements":3,"elements":["Mn","Zn","S"],"chemical_system":"Mn-S-Zn","density":4.393651949828434,"density_atomic":0.06385786171456007,"volume":187.91734764999046,"volume_molar":9.430539323284147,"formula_full":"Mn2 Zn2 S8","formula_reduced":"MnZnS4","formula_anonymous":"ABC4","energy":-62.6789679,"energy_per_atom":-5.223247325,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-58.6549679,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9973803,"is_theoretical":true,"updated_at":"2021-11-28T01:34:30.685000Z","spacegroup":14},{"id":"mp-771026","created_at":"2022-09-04T14:39:25.042686Z","structure_string":"Na4 B2 Sb2 S2 O14\n1.0\n6.906165 0.000000 0.000000\n0.000000 5.570771 0.000000\n0.000000 0.378058 9.500940\nNa B Sb S O\n4 2 2 2 14\ndirect\n0.497724 0.244122 0.802997 Na\n0.002276 0.244122 0.802997 Na\n0.502276 0.755878 0.197003 Na\n0.997724 0.755878 0.197003 Na\n0.750000 0.741265 0.912681 B\n0.250000 0.258735 0.087319 B\n0.750000 0.772628 0.644864 Sb\n0.250000 0.227372 0.355136 Sb\n0.250000 0.723187 0.604653 S\n0.750000 0.276813 0.395347 S\n0.250000 0.268671 0.950413 O\n0.750000 0.959164 0.822965 O\n0.750000 0.541918 0.818356 O\n0.077321 0.850070 0.665444 O\n0.422679 0.850070 0.665444 O\n0.750000 0.244018 0.552303 O\n0.250000 0.467059 0.646989 O\n0.750000 0.532941 0.353011 O\n0.250000 0.755982 0.447697 O\n0.577321 0.149930 0.334556 O\n0.922679 0.149930 0.334556 O\n0.250000 0.458082 0.181644 O\n0.250000 0.040836 0.177035 O\n0.750000 0.731329 0.049587 O\n","nsites":24,"nelements":5,"elements":["Na","B","Sb","S","O"],"chemical_system":"B-Na-O-S-Sb","density":2.9311624504929465,"density_atomic":0.06565871969231693,"volume":365.5264694844235,"volume_molar":9.171882711421013,"formula_full":"Na4 B2 Sb2 S2 O14","formula_reduced":"Na2BSbSO7","formula_anonymous":"ABCD2E7","energy":-156.24714358,"energy_per_atom":-6.510297649166667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-146.62914358,"band_gap":3.4585,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0040577,"is_theoretical":true,"updated_at":"2021-11-28T01:34:27.459000Z","spacegroup":11}]}