{"count":288,"next":"https://simmate.org/third-parties/AflowPrototype/?format=json&ordering=-structure_string&page=2","previous":null,"results":[{"id":118,"created_at":"2022-09-04T14:35:36.610582Z","updated_at":"2022-09-04T14:35:36.610613Z","structure_string":"Zr4 O8\n1.0\n5.083813 0.000000 -0.826130\n-0.000000 5.211600 0.000000\n0.000000 0.000000 5.317300\nZr O\n4 8\ndirect\n0.275400 0.039500 0.208300 Zr\n0.724600 0.539500 0.291700 Zr\n0.724600 0.960500 0.791700 Zr\n0.275400 0.460500 0.708300 Zr\n0.070000 0.331700 0.344700 O\n0.930000 0.831700 0.155300 O\n0.930000 0.668300 0.655300 O\n0.070000 0.168300 0.844700 O\n0.449600 0.756900 0.479200 O\n0.550400 0.256900 0.020800 O\n0.550400 0.243100 0.520800 O\n0.449600 0.743100 0.979200 O\n","nsites":12,"nelements":2,"elements":["Zr","O"],"chemical_system":"O-Zr","density":5.809628410527317,"density_atomic":0.08517839246530948,"volume":140.88079914031283,"volume_molar":7.070033356702091,"formula_full":"Zr4 O8","formula_reduced":"ZrO2","formula_anonymous":"AB2","mineral_name":"Baddeleyite","aflow_id":"A2B_mP12_14_2e_e","pearson_symbol":"mP12","strukturbericht_symbol":"C43","nsites_wyckoff":3,"spacegroup":14},{"id":196,"created_at":"2022-09-04T14:35:36.761754Z","updated_at":"2022-09-04T14:35:36.761778Z","structure_string":"Zr2 Si4\n1.0\n-0.000000 -0.000000 3.670000\n3.730000 -0.000000 0.000000\n-1.865000 7.360000 0.000000\nSi Zr\n4 2\ndirect\n0.250000 0.061000 0.122000 Si\n0.750000 0.939000 0.878000 Si\n0.250000 0.750000 0.500000 Si\n0.750000 0.250000 0.500000 Si\n0.250000 0.396000 0.792000 Zr\n0.750000 0.604000 0.208000 Zr\n","nsites":6,"nelements":2,"elements":["Si","Zr"],"chemical_system":"Si-Zr","density":4.858577494882214,"density_atomic":0.059552300100397235,"volume":100.751776,"volume_molar":10.112356281533163,"formula_full":"Zr2 Si4","formula_reduced":"ZrSi2","formula_anonymous":"AB2","mineral_name":"Zirconium Disilicide","aflow_id":"A2B_oC12_63_2c_c","pearson_symbol":"oC12","strukturbericht_symbol":"C49","nsites_wyckoff":3,"spacegroup":63},{"id":278,"created_at":"2022-09-04T14:35:36.956978Z","updated_at":"2022-09-04T14:35:36.956998Z","structure_string":"Zr2 Si2 O8\n1.0\n-3.302100 3.302100 -2.989800\n3.302100 -3.302100 -2.989800\n-3.302100 -3.302100 2.989800\nO Si Zr\n8 2 2\ndirect\n0.804900 0.738900 0.934000 O\n0.195100 0.261100 0.066000 O\n0.195100 0.629100 0.434000 O\n0.804900 0.370900 0.566000 O\n0.261100 0.195100 0.566000 O\n0.370900 0.804900 0.066000 O\n0.738900 0.804900 0.434000 O\n0.629100 0.195100 0.934000 O\n0.625000 0.375000 0.750000 Si\n0.375000 0.625000 0.250000 Si\n0.875000 0.125000 0.250000 Zr\n0.125000 0.875000 0.750000 Zr\n","nsites":12,"nelements":3,"elements":["O","Si","Zr"],"chemical_system":"O-Si-Zr","density":4.668483289194743,"density_atomic":0.09202348467556647,"volume":130.40149525207198,"volume_molar":6.544134664353743,"formula_full":"Zr2 Si2 O8","formula_reduced":"ZrSiO4","formula_anonymous":"ABC4","mineral_name":"Zircon","aflow_id":"A4BC_tI24_141_h_b_a","pearson_symbol":"tI24","strukturbericht_symbol":"None","nsites_wyckoff":3,"spacegroup":141},{"id":60,"created_at":"2022-09-04T14:35:36.879491Z","updated_at":"2022-09-04T14:35:36.879514Z","structure_string":"Zr2 Cu2 Si2 As2\n1.0\n3.673600 0.000000 0.000000\n-0.000000 3.673600 0.000000\n0.000000 0.000000 9.571200\nZr Cu Si As\n2 2 2 2\ndirect\n0.250000 0.250000 0.224600 Zr\n0.750000 0.750000 0.775400 Zr\n0.750000 0.250000 0.500000 Cu\n0.250000 0.750000 0.500000 Cu\n0.750000 0.250000 0.000000 Si\n0.250000 0.750000 0.000000 Si\n0.250000 0.250000 0.679300 As\n0.750000 0.750000 0.320700 As\n","nsites":8,"nelements":4,"elements":["Zr","Cu","Si","As"],"chemical_system":"As-Cu-Si-Zr","density":6.627859638436002,"density_atomic":0.06193553064873132,"volume":129.16656911155198,"volume_molar":9.723240758450428,"formula_full":"Zr2 Cu2 Si2 As2","formula_reduced":"ZrCuSiAs","formula_anonymous":"ABCD","mineral_name":"Parent of FeAs superconductors","aflow_id":"ABCD_tP8_129_c_b_a_c","pearson_symbol":"tP8","strukturbericht_symbol":"None","nsites_wyckoff":4,"spacegroup":129},{"id":13,"created_at":"2022-09-04T14:35:36.667805Z","updated_at":"2022-09-04T14:35:36.667826Z","structure_string":"Zr2 Al6\n1.0\n3.999300 -0.000000 -0.000000\n-0.000000 3.999300 0.000000\n-1.999650 -1.999650 8.641500\nAl Zr\n6 2\ndirect\n0.000000 0.500000 0.000000 Al\n0.500000 1.000000 0.000000 Al\n0.250000 0.750000 0.500000 Al\n0.750000 0.250000 0.500000 Al\n0.374980 0.374980 0.749960 Al\n0.625020 0.625020 0.250040 Al\n0.118860 0.118860 0.237720 Zr\n0.881140 0.881140 0.762280 Zr\n","nsites":8,"nelements":2,"elements":["Al","Zr"],"chemical_system":"Al-Zr","density":4.136909120237683,"density_atomic":0.057880581605996774,"volume":138.215611834335,"volume_molar":10.404423371198588,"formula_full":"Zr2 Al6","formula_reduced":"ZrAl3","formula_anonymous":"AB3","mineral_name":null,"aflow_id":"A3B_tI16_139_cde_e","pearson_symbol":"tI16","strukturbericht_symbol":"D0_23","nsites_wyckoff":4,"spacegroup":139},{"id":131,"created_at":"2022-09-04T14:35:36.958571Z","updated_at":"2022-09-04T14:35:36.958594Z","structure_string":"Zr1 Pb1 O3\n1.0\n4.046000 0.000000 0.000000\n-0.000000 4.046000 0.000000\n0.000000 0.000000 4.139400\nZr Pb O\n1 1 3\ndirect\n0.500000 0.500000 0.451700 Zr\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.897300 O\n0.500000 0.000000 0.378500 O\n0.000000 0.500000 0.378500 O\n","nsites":5,"nelements":3,"elements":["Zr","Pb","O"],"chemical_system":"O-Pb-Zr","density":8.489178405998235,"density_atomic":0.07378716969544796,"volume":67.76245817040001,"volume_molar":8.161501226915219,"formula_full":"Zr1 Pb1 O3","formula_reduced":"ZrPbO3","formula_anonymous":"ABC3","mineral_name":"Pb(Zr_(1-x)Ti_x)O3","aflow_id":"A3BC_tP5_99_bc_a_b","pearson_symbol":"tP5","strukturbericht_symbol":"None","nsites_wyckoff":4,"spacegroup":99},{"id":271,"created_at":"2022-09-04T14:35:36.779435Z","updated_at":"2022-09-04T14:35:36.779455Z","structure_string":"Zr1 Pb1 O3\n1.0\n-2.860912 -2.854785 0.024867\n-2.860912 2.854785 0.024867\n0.000000 0.000000 -4.136510\nO Pb Zr\n3 1 1\ndirect\n0.448500 0.448500 0.099400 O\n0.468600 0.955400 0.627100 O\n0.955400 0.468600 0.627100 O\n0.000000 0.000000 0.000000 Pb\n0.477000 0.477000 0.550800 Zr\n","nsites":5,"nelements":3,"elements":["O","Pb","Zr"],"chemical_system":"O-Pb-Zr","density":8.513591992820736,"density_atomic":0.07399937038055472,"volume":67.56814246238345,"volume_molar":8.138097296004123,"formula_full":"Zr1 Pb1 O3","formula_reduced":"ZrPbO3","formula_anonymous":"ABC3","mineral_name":"Pb (Zr_0.50 Ti_0.48) O_3","aflow_id":"A3BC_mC10_8_ab_a_a","pearson_symbol":"mC10","strukturbericht_symbol":"None","nsites_wyckoff":4,"spacegroup":8},{"id":138,"created_at":"2022-09-04T14:35:37.076424Z","updated_at":"2022-09-04T14:35:37.076457Z","structure_string":"Zn3 Ag6\n1.0\n0.000000 0.000000 -2.819700\n-3.818000 -6.612970 -0.000000\n-3.818000 6.612970 0.000000\nZn Ag\n3 6\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.666670 0.333340 Zn\n0.250000 0.333330 0.666660 Zn\n0.750000 0.666670 0.666670 Ag\n0.750000 1.000000 0.333330 Ag\n0.750000 0.333330 1.000000 Ag\n0.250000 0.333330 0.333330 Ag\n0.250000 1.000000 0.666670 Ag\n0.250000 0.666670 0.000000 Ag\n","nsites":9,"nelements":2,"elements":["Zn","Ag"],"chemical_system":"Ag-Zn","density":9.836394940782235,"density_atomic":0.06320873995250843,"volume":142.38537276272402,"volume_molar":9.5273861882466,"formula_full":"Zn3 Ag6","formula_reduced":"ZnAg2","formula_anonymous":"AB2","mineral_name":"zeta silver zinc","aflow_id":"A2B_hP9_147_g_ad","pearson_symbol":"hP9","strukturbericht_symbol":"B_b","nsites_wyckoff":3,"spacegroup":147},{"id":64,"created_at":"2022-09-04T14:35:36.948308Z","updated_at":"2022-09-04T14:35:36.948337Z","structure_string":"Zn2 S2\n1.0\n-1.911350 -3.310555 -0.000000\n-1.911350 3.310555 0.000000\n0.000000 0.000000 -6.260700\nZn S\n2 2\ndirect\n0.666670 0.333340 0.000000 Zn\n0.333340 0.666670 0.500000 Zn\n0.666670 0.333340 0.625200 S\n0.333340 0.666670 0.125200 S\n","nsites":4,"nelements":2,"elements":["Zn","S"],"chemical_system":"S-Zn","density":4.0857704561130515,"density_atomic":0.05048543161923218,"volume":79.23077750762894,"volume_molar":11.928472366879587,"formula_full":"Zn2 S2","formula_reduced":"ZnS","formula_anonymous":"AB","mineral_name":"Wurtzite","aflow_id":"AB_hP4_186_b_b","pearson_symbol":"hP4","strukturbericht_symbol":"B4","nsites_wyckoff":2,"spacegroup":186},{"id":19,"created_at":"2022-09-04T14:35:36.794163Z","updated_at":"2022-09-04T14:35:36.794191Z","structure_string":"Zn1 S1\n1.0\n-2.704650 -2.704650 0.000000\n-2.704650 0.000000 -2.704650\n0.000000 -2.704650 -2.704650\nS Zn\n1 1\ndirect\n0.750000 0.750000 0.750000 S\n0.000000 0.000000 0.000000 Zn\n","nsites":2,"nelements":2,"elements":["S","Zn"],"chemical_system":"S-Zn","density":4.090483761101026,"density_atomic":0.05054367112123723,"volume":39.56974148558925,"volume_molar":11.914727653151497,"formula_full":"Zn1 S1","formula_reduced":"ZnS","formula_anonymous":"AB","mineral_name":"Zincblende, Sphalerite","aflow_id":"AB_cF8_216_c_a","pearson_symbol":"cF8","strukturbericht_symbol":"B3","nsites_wyckoff":2,"spacegroup":216},{"id":98,"created_at":"2022-09-04T14:35:37.065788Z","updated_at":"2022-09-04T14:35:37.065810Z","structure_string":"Zn16 Cu10\n1.0\n-4.433200 -4.433200 4.433200\n-4.433200 4.433200 -4.433200\n4.433200 -4.433200 -4.433200\nCu Zn\n10 16\ndirect\n0.344520 0.344520 0.344520 Cu\n1.000000 1.000000 0.655480 Cu\n1.000000 0.655480 1.000000 Cu\n0.655480 0.000000 0.000000 Cu\n0.355790 0.355790 1.000000 Cu\n0.644210 0.644210 0.000000 Cu\n1.000000 0.355790 0.355790 Cu\n0.000000 0.644210 0.644210 Cu\n0.355790 1.000000 0.355790 Cu\n0.644210 1.000000 0.644210 Cu\n0.784380 0.784380 0.784380 Zn\n1.000000 0.000000 0.215620 Zn\n0.000000 0.215620 0.000000 Zn\n0.215620 0.000000 1.000000 Zn\n0.623120 0.274820 0.274820 Zn\n0.000000 0.348300 0.725180 Zn\n0.000000 0.725180 0.348300 Zn\n0.376880 0.651700 0.651700 Zn\n0.274820 0.623120 0.274820 Zn\n0.348300 1.000000 0.725180 Zn\n0.651700 0.376880 0.651700 Zn\n0.725180 0.000000 0.348300 Zn\n0.274820 0.274820 0.623120 Zn\n0.651700 0.651700 0.376880 Zn\n0.348300 0.725180 0.000000 Zn\n0.725180 0.348300 1.000000 Zn\n","nsites":26,"nelements":2,"elements":["Cu","Zn"],"chemical_system":"Cu-Zn","density":8.014273451379138,"density_atomic":0.0746038745199409,"volume":348.5073686494721,"volume_molar":8.072155499632046,"formula_full":"Zn16 Cu10","formula_reduced":"Zn8Cu5","formula_anonymous":"A5B8","mineral_name":"gamma-brass","aflow_id":"A5B8_cI52_217_ce_cg","pearson_symbol":"cI52","strukturbericht_symbol":"None","nsites_wyckoff":4,"spacegroup":217},{"id":97,"created_at":"2022-09-04T14:35:37.023441Z","updated_at":"2022-09-04T14:35:37.023465Z","structure_string":"W1 C1\n1.0\n0.000000 0.000000 -2.836600\n-1.453250 -2.517103 -0.000000\n-1.453250 2.517103 0.000000\nW C\n1 1\ndirect\n0.000000 0.000000 0.000000 W\n0.500000 0.666670 0.333340 C\n","nsites":2,"nelements":2,"elements":["W","C"],"chemical_system":"C-W","density":15.671292348528352,"density_atomic":0.09637415485016146,"volume":20.7524517658237,"volume_molar":6.248709282445045,"formula_full":"W1 C1","formula_reduced":"WC","formula_anonymous":"AB","mineral_name":"Tungsten Carbide","aflow_id":"AB_hP2_187_d_a","pearson_symbol":"hP2","strukturbericht_symbol":"B_h","nsites_wyckoff":2,"spacegroup":187}]}