{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-formula_anonymous&page=69","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-formula_anonymous&page=67","results":[{"id":"mp-1218208","created_at":"2022-09-04T14:40:03.586230Z","structure_string":"Sr2 La2 Mg2 Ru2 O12\n1.0\n5.650880 0.000000 0.000000\n0.000000 5.640667 0.000000\n0.000000 5.601343 7.948101\nSr La Mg Ru O\n2 2 2 2 12\ndirect\n0.226310 0.245069 0.250969 Sr\n0.773690 0.245069 0.750969 Sr\n0.282352 0.760009 0.750471 La\n0.717648 0.760009 0.250471 La\n0.752773 0.500093 0.000650 Mg\n0.247227 0.500093 0.500650 Mg\n0.751157 0.999202 0.500428 Ru\n0.248843 0.999202 0.000428 Ru\n0.961853 0.766589 0.457646 O\n0.038147 0.766589 0.957646 O\n0.526616 0.226072 0.538128 O\n0.473384 0.226072 0.038128 O\n0.028849 0.166319 0.542035 O\n0.971151 0.166319 0.042035 O\n0.484182 0.817591 0.459868 O\n0.515818 0.817591 0.959868 O\n0.760334 0.327624 0.256780 O\n0.239666 0.327624 0.756780 O\n0.732589 0.691432 0.743026 O\n0.267411 0.691432 0.243026 O\n","nsites":20,"nelements":5,"elements":["Sr","La","Mg","Ru","O"],"chemical_system":"La-Mg-O-Ru-Sr","density":5.871474740549627,"density_atomic":0.07894417160940105,"volume":253.3435919621241,"volume_molar":7.62835385719958,"formula_full":"Sr2 La2 Mg2 Ru2 O12","formula_reduced":"SrLaMgRuO6","formula_anonymous":"ABCDE6","energy":-150.58160803,"energy_per_atom":-7.529080401500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-142.33760803,"band_gap":0.3373999999999997,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":5.9999171,"is_theoretical":true,"updated_at":"2021-11-28T01:34:46.011000Z","spacegroup":7},{"id":"mp-1518820","created_at":"2022-09-04T14:40:03.755587Z","structure_string":"Ba4 Sr4 Tb4 W4 O24\n1.0\n8.426349 0.000000 0.000000\n0.000000 8.449095 0.000000\n0.000000 0.000000 8.493071\nBa Sr Tb W O\n4 4 4 4 24\ndirect\n0.000000 -0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 -0.000000 0.500000 Ba\n0.000000 0.500000 0.500000 Sr\n0.500000 -0.000000 0.500000 Sr\n0.500000 -0.000000 0.000000 Sr\n0.000000 0.500000 0.000000 Sr\n0.750000 0.750000 0.750000 Tb\n0.250000 0.250000 0.750000 Tb\n0.250000 0.750000 0.250000 Tb\n0.750000 0.250000 0.250000 Tb\n0.250000 0.250000 0.250000 W\n0.750000 0.750000 0.250000 W\n0.750000 0.250000 0.750000 W\n0.250000 0.750000 0.750000 W\n0.015294 0.226905 0.276607 O\n0.984706 0.773095 0.276607 O\n0.984706 0.226905 0.723393 O\n0.015294 0.773095 0.723393 O\n0.281534 0.015538 0.218575 O\n0.281534 0.984462 0.781425 O\n0.718466 0.984462 0.218575 O\n0.718466 0.015538 0.781425 O\n0.219135 0.281486 0.012783 O\n0.780865 0.281486 0.987217 O\n0.219135 0.718514 0.987217 O\n0.780865 0.718514 0.012783 O\n0.484706 0.273095 0.223393 O\n0.515294 0.726905 0.223393 O\n0.515294 0.273095 0.776607 O\n0.484706 0.726905 0.776607 O\n0.218466 0.484462 0.281425 O\n0.218466 0.515538 0.718575 O\n0.781534 0.515538 0.281425 O\n0.781534 0.484462 0.718575 O\n0.280865 0.218514 0.487217 O\n0.719135 0.218514 0.512783 O\n0.280865 0.781486 0.512783 O\n0.719135 0.781486 0.487217 O\n","nsites":40,"nelements":5,"elements":["Ba","Sr","Tb","W","O"],"chemical_system":"Ba-O-Sr-Tb-W","density":7.290750585355136,"density_atomic":0.0661523993562447,"volume":604.6643869195359,"volume_molar":9.103435126471371,"formula_full":"Ba4 Sr4 Tb4 W4 O24","formula_reduced":"BaSrTbWO6","formula_anonymous":"ABCDE6","energy":-328.68886666000003,"energy_per_atom":-8.2172216665,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-294.44886666,"band_gap":1.7994,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":4.0000001,"is_theoretical":true,"updated_at":"2021-11-28T01:34:45.494000Z","spacegroup":48},{"id":"mp-1517428","created_at":"2022-09-04T14:42:00.221251Z","structure_string":"K1 Pr1 Gd1 Ge1 O6\n1.0\n0.000000 -4.108036 -4.108036\n4.108036 0.000000 -4.108036\n4.108036 -4.108036 0.000000\nK Pr Gd Ge O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Pr\n0.000000 0.000000 0.000000 Gd\n0.500000 0.500000 0.500000 Ge\n0.730524 0.269476 0.269476 O\n0.269476 0.730524 0.730524 O\n0.730524 0.269476 0.730524 O\n0.269476 0.730524 0.269476 O\n0.730524 0.730524 0.269476 O\n0.269476 0.269476 0.730524 O\n","nsites":10,"nelements":5,"elements":["K","Pr","Gd","Ge","O"],"chemical_system":"Gd-Ge-K-O-Pr","density":6.0586308449424235,"density_atomic":0.07212192035267931,"volume":138.65410059936795,"volume_molar":8.349945107605942,"formula_full":"K1 Pr1 Gd1 Ge1 O6","formula_reduced":"KPrGdGeO6","formula_anonymous":"ABCDE6","energy":-81.06529509,"energy_per_atom":-8.106529509000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-76.94329509,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.0000003,"is_theoretical":true,"updated_at":"2021-11-28T01:35:32.643000Z","spacegroup":216},{"id":"mp-1518654","created_at":"2022-09-04T14:40:34.237156Z","structure_string":"K1 Eu1 Hf1 Sn1 O6\n1.0\n0.000000 -4.114192 -4.114192\n4.114192 -0.000000 -4.114192\n4.114192 -4.114192 0.000000\nK Eu Hf Sn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Eu\n0.000000 -0.000000 0.000000 Hf\n0.500000 0.500000 0.500000 Sn\n0.749971 0.250029 0.250029 O\n0.250029 0.749971 0.749971 O\n0.749971 0.250029 0.749971 O\n0.250029 0.749971 0.250029 O\n0.749971 0.749971 0.250029 O\n0.250029 0.250029 0.749971 O\n","nsites":10,"nelements":5,"elements":["K","Eu","Hf","Sn","O"],"chemical_system":"Eu-Hf-K-O-Sn","density":6.965793949532117,"density_atomic":0.07179865988086342,"volume":139.27836559335714,"volume_molar":8.387539224259376,"formula_full":"K1 Eu1 Hf1 Sn1 O6","formula_reduced":"KEuHfSnO6","formula_anonymous":"ABCDE6","energy":-83.42135162,"energy_per_atom":-8.342135162,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-79.29935162,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":5.9999999,"is_theoretical":true,"updated_at":"2021-11-28T01:35:05.962000Z","spacegroup":216},{"id":"mp-1516212","created_at":"2022-09-04T14:45:37.077463Z","structure_string":"Na1 Ca1 Zr1 W1 O6\n1.0\n0.000000 -4.068532 -4.068532\n4.068532 0.000000 -4.068532\n4.068532 -4.068532 0.000000\nNa Ca Zr W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.500000 W\n0.742971 0.257029 0.257029 O\n0.257029 0.742971 0.742971 O\n0.742971 0.257029 0.742971 O\n0.257029 0.742971 0.257029 O\n0.742971 0.742971 0.257029 O\n0.257029 0.257029 0.742971 O\n","nsites":10,"nelements":5,"elements":["Na","Ca","Zr","W","O"],"chemical_system":"Ca-Na-O-W-Zr","density":5.352095573201042,"density_atomic":0.07424321938699127,"volume":134.69243498015896,"volume_molar":8.111368027576653,"formula_full":"Na1 Ca1 Zr1 W1 O6","formula_reduced":"NaCaZrWO6","formula_anonymous":"ABCDE6","energy":-82.56086980999999,"energy_per_atom":-8.256086981,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-74.00086981,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.0005247,"is_theoretical":true,"updated_at":"2021-11-28T01:37:13.079000Z","spacegroup":216},{"id":"mp-1518297","created_at":"2022-09-04T14:45:38.479924Z","structure_string":"Ba2 Eu2 Y2 Sb2 O12\n1.0\n5.959057 0.014528 0.009034\n0.016193 5.973992 -0.011476\n0.014416 -0.014710 8.435103\nBa Eu Y Sb O\n2 2 2 2 12\ndirect\n0.995784 0.017725 0.249828 Ba\n0.004216 0.982275 0.750172 Ba\n0.503823 0.527388 0.251098 Eu\n0.496177 0.472612 0.748902 Eu\n0.500000 0.000000 0.000000 Y\n0.000000 0.500000 0.500000 Y\n0.000000 0.500000 0.000000 Sb\n0.500000 0.000000 0.500000 Sb\n0.211437 0.239526 0.968374 O\n0.297830 0.730989 0.533947 O\n0.788563 0.760474 0.031626 O\n0.702170 0.269011 0.466053 O\n0.266008 0.705008 0.963261 O\n0.240281 0.213426 0.527852 O\n0.733992 0.294992 0.036739 O\n0.759719 0.786574 0.472148 O\n0.449164 0.977280 0.264028 O\n0.073386 0.497832 0.235283 O\n0.550836 0.022720 0.735972 O\n0.926614 0.502168 0.764717 O\n","nsites":20,"nelements":5,"elements":["Ba","Eu","Y","Sb","O"],"chemical_system":"Ba-Eu-O-Sb-Y","density":6.59119523682635,"density_atomic":0.06660439473486704,"volume":300.2804856888837,"volume_molar":9.041656761498116,"formula_full":"Ba2 Eu2 Y2 Sb2 O12","formula_reduced":"BaEuYSbO6","formula_anonymous":"ABCDE6","energy":-165.92733015,"energy_per_atom":-8.2963665075,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-157.68333015,"band_gap":0.0598999999999998,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":13.99998,"is_theoretical":true,"updated_at":"2021-11-28T01:37:02.528000Z","spacegroup":2},{"id":"mp-1523280","created_at":"2022-09-04T14:42:18.334265Z","structure_string":"Ba1 Eu1 Zr1 Nb1 O6\n1.0\n-0.000000 -4.170808 -4.170808\n4.170808 0.000000 -4.170808\n4.170808 -4.170808 0.000000\nBa Eu Zr Nb O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 -0.000000 Nb\n0.754180 0.245820 0.245820 O\n0.245820 0.754180 0.754180 O\n0.754180 0.245820 0.754180 O\n0.245820 0.754180 0.245820 O\n0.754180 0.754180 0.245820 O\n0.245820 0.245820 0.754180 O\n","nsites":10,"nelements":5,"elements":["Ba","Eu","Zr","Nb","O"],"chemical_system":"Ba-Eu-Nb-O-Zr","density":6.5161268768135665,"density_atomic":0.0689143097634769,"volume":145.10774372291232,"volume_molar":8.738592580653844,"formula_full":"Ba1 Eu1 Zr1 Nb1 O6","formula_reduced":"BaEuZrNbO6","formula_anonymous":"ABCDE6","energy":-94.03754979,"energy_per_atom":-9.403754979,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-89.91554979,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.6693043,"is_theoretical":true,"updated_at":"2021-11-28T01:35:45.616000Z","spacegroup":216},{"id":"mp-1518884","created_at":"2022-09-04T14:44:26.181135Z","structure_string":"Ba1 Ca1 Mn1 Sn1 O6\n1.0\n0.000000 -4.011772 -4.011772\n4.011772 0.000000 -4.011772\n4.011772 -4.011772 0.000000\nBa Ca Mn Sn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ca\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Sn\n0.757553 0.242447 0.242447 O\n0.242447 0.757553 0.757553 O\n0.757553 0.242447 0.757553 O\n0.242447 0.757553 0.242447 O\n0.757553 0.757553 0.242447 O\n0.242447 0.242447 0.757553 O\n","nsites":10,"nelements":5,"elements":["Ba","Ca","Mn","Sn","O"],"chemical_system":"Ba-Ca-Mn-O-Sn","density":5.7486508632269855,"density_atomic":0.07743927450891269,"volume":129.13344118234312,"volume_molar":7.776597596232511,"formula_full":"Ba1 Ca1 Mn1 Sn1 O6","formula_reduced":"BaCaMnSnO6","formula_anonymous":"ABCDE6","energy":-71.06897617000001,"energy_per_atom":-7.106897617000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-65.27897617,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.000105,"is_theoretical":true,"updated_at":"2021-11-28T01:36:39.796000Z","spacegroup":216},{"id":"mp-1522044","created_at":"2022-09-04T14:42:55.243403Z","structure_string":"Ba1 Sr1 Dy1 Mn1 O6\n1.0\n-0.000000 -4.146373 -4.146373\n4.146373 -0.000000 -4.146373\n4.146373 -4.146373 -0.000000\nBa Sr Dy Mn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Sr\n-0.000000 0.000000 -0.000000 Dy\n0.500000 0.500000 0.500000 Mn\n0.732123 0.267877 0.267877 O\n0.267877 0.732123 0.732123 O\n0.732123 0.267877 0.732123 O\n0.267877 0.732123 0.267877 O\n0.732123 0.732123 0.267877 O\n0.267877 0.267877 0.732123 O\n","nsites":10,"nelements":5,"elements":["Ba","Sr","Dy","Mn","O"],"chemical_system":"Ba-Dy-Mn-O-Sr","density":6.270527575462659,"density_atomic":0.07013986099009671,"volume":142.57228142228476,"volume_molar":8.58590347199332,"formula_full":"Ba1 Sr1 Dy1 Mn1 O6","formula_reduced":"BaSrDyMnO6","formula_anonymous":"ABCDE6","energy":-75.41980930000001,"energy_per_atom":-7.541980930000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-69.6298093,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0000004,"is_theoretical":true,"updated_at":"2021-11-28T01:35:58.695000Z","spacegroup":216},{"id":"mp-1520190","created_at":"2022-09-04T14:42:55.018624Z","structure_string":"Ba1 Ce1 In1 Sb1 O6\n1.0\n0.000000 -4.280861 -4.280861\n4.280861 0.000000 -4.280861\n4.280861 -4.280861 0.000000\nBa Ce In Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Ce\n0.750000 0.750000 0.750000 In\n0.500000 0.500000 0.500000 Sb\n0.736761 0.263239 0.263239 O\n0.263239 0.736761 0.736761 O\n0.736761 0.263239 0.736761 O\n0.263239 0.736761 0.263239 O\n0.736761 0.736761 0.263239 O\n0.263239 0.263239 0.736761 O\n","nsites":10,"nelements":5,"elements":["Ba","Ce","In","Sb","O"],"chemical_system":"Ba-Ce-In-O-Sb","density":6.45606575877369,"density_atomic":0.06373479964438265,"volume":156.9001558927998,"volume_molar":9.44874824052384,"formula_full":"Ba1 Ce1 In1 Sb1 O6","formula_reduced":"BaCeInSbO6","formula_anonymous":"ABCDE6","energy":-70.62592303,"energy_per_atom":-7.062592303,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-66.50392303,"band_gap":0.3104999999999993,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:36:00.181000Z","spacegroup":216},{"id":"mp-1516899","created_at":"2022-09-04T14:42:11.412664Z","structure_string":"Na2 Pr2 Cu2 W2 O12\n1.0\n5.369335 0.000000 0.000000\n0.000000 5.369335 0.000000\n0.000000 0.000000 8.571917\nNa Pr Cu W O\n2 2 2 2 12\ndirect\n0.000000 0.500000 0.250000 Na\n0.500000 0.000000 0.750000 Na\n0.500000 0.000000 0.250000 Pr\n0.000000 0.500000 0.750000 Pr\n0.000000 0.000000 -0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 W\n0.500000 0.500000 -0.000000 W\n0.000000 0.000000 0.271308 O\n0.500000 0.500000 0.228692 O\n0.000000 0.000000 0.728692 O\n0.500000 0.500000 0.771308 O\n0.316072 0.188628 0.006411 O\n0.683928 0.811372 0.006411 O\n0.811372 0.316072 0.993589 O\n0.188628 0.683928 0.993589 O\n0.816072 0.311372 0.506411 O\n0.183928 0.688628 0.506411 O\n0.311372 0.183928 0.493589 O\n0.688628 0.816072 0.493589 O\n","nsites":20,"nelements":5,"elements":["Na","Pr","Cu","W","O"],"chemical_system":"Cu-Na-O-Pr-W","density":6.817226434216915,"density_atomic":0.08093027878007138,"volume":247.1262956396103,"volume_molar":7.441146689195538,"formula_full":"Na2 Pr2 Cu2 W2 O12","formula_reduced":"NaPrCuWO6","formula_anonymous":"ABCDE6","energy":-151.45066467,"energy_per_atom":-7.572533233500001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-134.33066467,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0000003,"is_theoretical":true,"updated_at":"2021-11-28T01:35:38.216000Z","spacegroup":118},{"id":"mp-1519728","created_at":"2022-09-04T14:41:51.206085Z","structure_string":"K1 Sr1 Pr1 W1 O6\n1.0\n0.000000 -4.298987 -4.298987\n4.298987 -0.000000 -4.298987\n4.298987 -4.298987 0.000000\nK Sr Pr W O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 W\n0.727129 0.272871 0.272871 O\n0.272871 0.727129 0.727129 O\n0.727129 0.272871 0.727129 O\n0.272871 0.727129 0.272871 O\n0.727129 0.727129 0.272871 O\n0.272871 0.272871 0.727129 O\n","nsites":10,"nelements":5,"elements":["K","Sr","Pr","W","O"],"chemical_system":"K-O-Pr-Sr-W","density":5.721039728322475,"density_atomic":0.06293201084862966,"volume":158.90164425308123,"volume_molar":9.569280686875002,"formula_full":"K1 Sr1 Pr1 W1 O6","formula_reduced":"KSrPrWO6","formula_anonymous":"ABCDE6","energy":-78.59312374,"energy_per_atom":-7.859312374,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-70.03312374,"band_gap":2.8602,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:27.774000Z","spacegroup":216}]}