{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=structure_string&page=10155","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=structure_string&page=10153","results":[{"id":"mp-510607","created_at":"2022-09-04T14:43:52.180558Z","structure_string":"Sr4 Cr4 O16\n1.0\n7.503895 0.000000 0.000000\n0.000000 6.841669 0.000000\n0.000000 5.195125 7.014956\nSr Cr O\n4 4 16\ndirect\n0.343998 0.326111 0.774201 Sr\n0.843998 0.673889 0.725799 Sr\n0.656002 0.673889 0.225799 Sr\n0.156002 0.326111 0.274201 Sr\n0.337155 0.812537 0.803308 Cr\n0.837155 0.187463 0.696692 Cr\n0.662845 0.187463 0.196692 Cr\n0.162845 0.812537 0.303308 Cr\n0.285108 0.094078 0.620060 O\n0.785108 0.905922 0.879940 O\n0.714892 0.905922 0.379940 O\n0.214892 0.094078 0.120060 O\n0.496499 0.694826 0.747203 O\n0.996499 0.305174 0.752797 O\n0.503501 0.305174 0.252797 O\n0.003501 0.694826 0.247203 O\n0.401480 0.833989 0.974606 O\n0.901480 0.166011 0.525394 O\n0.598520 0.166011 0.025394 O\n0.098520 0.833989 0.474606 O\n0.161787 0.624652 0.881158 O\n0.661787 0.375348 0.618842 O\n0.838213 0.375348 0.118842 O\n0.338213 0.624652 0.381158 O\n","nsites":24,"nelements":3,"elements":["Sr","Cr","O"],"chemical_system":"Cr-O-Sr","density":3.755280011921196,"density_atomic":0.06664038274286785,"volume":360.1419891690011,"volume_molar":9.036773968175499,"formula_full":"Sr4 Cr4 O16","formula_reduced":"SrCrO4","formula_anonymous":"ABC4","energy":-183.32082213,"energy_per_atom":-7.63836758875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-164.33282213,"band_gap":2.6186000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006396,"is_theoretical":false,"updated_at":"2021-11-28T01:36:25.073000Z","spacegroup":14},{"id":"mp-1179191","created_at":"2022-09-04T14:44:00.979488Z","structure_string":"Sr4 Cr4 O16\n1.0\n7.912390 0.000000 0.000000\n0.000000 7.314214 0.000000\n0.000000 0.600239 7.404815\nSr Cr O\n4 4 16\ndirect\n0.558151 0.224071 0.131657 Sr\n0.058151 0.275929 0.868343 Sr\n0.441849 0.775929 0.868343 Sr\n0.941849 0.724071 0.131657 Sr\n0.546104 0.249362 0.679700 Cr\n0.046104 0.250638 0.320300 Cr\n0.453896 0.750638 0.320300 Cr\n0.953896 0.749362 0.679700 Cr\n0.547894 0.444629 0.833933 O\n0.047894 0.055371 0.166067 O\n0.452106 0.555371 0.166067 O\n0.952106 0.944629 0.833933 O\n0.587164 0.239159 0.459939 O\n0.087164 0.260841 0.540061 O\n0.412836 0.760841 0.540061 O\n0.912836 0.739159 0.459939 O\n0.602113 0.059873 0.829201 O\n0.102113 0.440127 0.170799 O\n0.397887 0.940127 0.170799 O\n0.897887 0.559873 0.829201 O\n0.874864 0.138020 0.178674 O\n0.374864 0.361980 0.821326 O\n0.125136 0.861980 0.821326 O\n0.625136 0.638020 0.178674 O\n","nsites":24,"nelements":3,"elements":["Sr","Cr","O"],"chemical_system":"Cr-O-Sr","density":3.1559239099326226,"density_atomic":0.05600433964914447,"volume":428.5382195443247,"volume_molar":10.752989496398778,"formula_full":"Sr4 Cr4 O16","formula_reduced":"SrCrO4","formula_anonymous":"ABC4","energy":-168.22496994,"energy_per_atom":-7.0093737475,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-152.78896994,"band_gap":2.2329,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.0005553,"is_theoretical":true,"updated_at":"2021-11-28T01:36:30.749000Z","spacegroup":14},{"id":"mp-603935","created_at":"2022-09-04T14:45:56.407129Z","structure_string":"Sr4 Cr4 O16\n1.0\n8.340323 0.000000 0.000000\n0.000000 7.070519 0.000000\n0.000000 0.270797 7.337755\nSr Cr O\n4 4 16\ndirect\n0.953871 0.242454 0.169646 Sr\n0.453871 0.257546 0.830354 Sr\n0.046129 0.757546 0.830354 Sr\n0.546129 0.742454 0.169646 Sr\n0.498839 0.715799 0.722197 Cr\n0.501161 0.284201 0.277803 Cr\n0.001161 0.215799 0.722197 Cr\n0.998839 0.784201 0.277803 Cr\n0.474954 0.082864 0.170620 O\n0.525046 0.917136 0.829380 O\n0.134938 0.935582 0.194364 O\n0.822247 0.878291 0.209761 O\n0.974954 0.417136 0.829380 O\n0.492943 0.258812 0.500532 O\n0.865062 0.064418 0.805636 O\n0.322247 0.621709 0.790239 O\n0.025046 0.582864 0.170620 O\n0.507057 0.741188 0.499468 O\n0.007057 0.758812 0.500532 O\n0.634938 0.564418 0.805636 O\n0.365062 0.435582 0.194364 O\n0.677753 0.378291 0.209761 O\n0.177753 0.121709 0.790239 O\n0.992943 0.241188 0.499468 O\n","nsites":24,"nelements":3,"elements":["Sr","Cr","O"],"chemical_system":"Cr-O-Sr","density":3.12549431896953,"density_atomic":0.05546434274290792,"volume":432.71043724878206,"volume_molar":10.857679839305469,"formula_full":"Sr4 Cr4 O16","formula_reduced":"SrCrO4","formula_anonymous":"ABC4","energy":-181.20509336,"energy_per_atom":-7.550212223333333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-162.21709336,"band_gap":2.5639,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:37:12.615000Z","spacegroup":14},{"id":"mp-1179431","created_at":"2022-09-04T14:45:37.258459Z","structure_string":"Sr4 Cr4 O16\n1.0\n9.668895 1.340105 0.000000\n-1.151297 6.290375 0.000000\n0.000000 0.000000 7.600817\nSr Cr O\n4 4 16\ndirect\n0.361376 0.167419 0.092803 Sr\n0.138624 0.832581 0.592803 Sr\n0.638624 0.832581 0.907197 Sr\n0.861376 0.167419 0.407197 Sr\n0.265424 0.685088 0.105355 Cr\n0.234576 0.314912 0.605355 Cr\n0.734576 0.314912 0.894645 Cr\n0.765424 0.685088 0.394645 Cr\n0.245273 0.459073 0.266629 O\n0.254727 0.540927 0.766629 O\n0.754727 0.540927 0.733371 O\n0.745273 0.459073 0.233371 O\n0.431789 0.792292 0.071538 O\n0.068211 0.207708 0.571538 O\n0.568211 0.207708 0.928462 O\n0.931789 0.792292 0.428462 O\n0.669159 0.900679 0.377597 O\n0.830841 0.099321 0.877597 O\n0.330841 0.099321 0.622403 O\n0.169159 0.900679 0.122403 O\n0.726435 0.463174 0.555607 O\n0.773565 0.536826 0.055607 O\n0.273565 0.536826 0.444393 O\n0.226435 0.463174 0.944393 O\n","nsites":24,"nelements":3,"elements":["Sr","Cr","O"],"chemical_system":"Cr-O-Sr","density":2.853139455479041,"density_atomic":0.05063119254178556,"volume":474.0160915663397,"volume_molar":11.894131774656444,"formula_full":"Sr4 Cr4 O16","formula_reduced":"SrCrO4","formula_anonymous":"ABC4","energy":-164.08447253,"energy_per_atom":-6.836853022083333,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-153.51247253,"band_gap":1.6033,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.0019068,"is_theoretical":true,"updated_at":"2021-11-28T01:37:02.438000Z","spacegroup":14},{"id":"mp-1282494","created_at":"2022-09-04T14:44:13.079432Z","structure_string":"Sr4 Cr4 O8\n1.0\n4.073310 0.000002 3.472926\n4.073564 -4.068846 -3.473215\n4.073562 4.068838 -3.473208\nSr Cr O\n4 4 8\ndirect\n0.502282 0.251566 0.751567 Sr\n0.997707 0.498436 0.998433 Sr\n0.502281 0.751568 0.251565 Sr\n0.997710 0.998432 0.498433 Sr\n0.010087 0.494104 0.494098 Cr\n0.489907 0.755907 0.755905 Cr\n0.010005 0.994108 0.994114 Cr\n0.490020 0.255883 0.255889 Cr\n0.001620 0.248936 0.748938 O\n0.498415 0.501042 0.001042 O\n0.001619 0.748937 0.248937 O\n0.498417 0.001043 0.501044 O\n0.249912 0.625049 0.625047 O\n0.750041 0.874962 0.874961 O\n0.249906 0.125053 0.125052 O\n0.750071 0.374975 0.374975 O\n","nsites":16,"nelements":3,"elements":["Sr","Cr","O"],"chemical_system":"Cr-O-Sr","density":4.950612486939679,"density_atomic":0.06948880372244425,"volume":230.2529205123177,"volume_molar":8.666346860789178,"formula_full":"Sr4 Cr4 O8","formula_reduced":"SrCrO2","formula_anonymous":"ABC2","energy":-125.48961612,"energy_per_atom":-7.8431010075,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-111.99761612,"band_gap":1.3443000000000005,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.5e-06,"is_theoretical":true,"updated_at":"2021-11-28T01:36:28.654000Z","spacegroup":65},{"id":"mp-1179211","created_at":"2022-09-04T14:47:57.716924Z","structure_string":"Sr4 Cr4 P8 O28\n1.0\n8.438376 0.000000 0.000000\n0.000000 5.494717 0.000000\n0.000000 5.399332 12.758408\nSr Cr P O\n4 4 8 28\ndirect\n0.410088 0.988372 0.222043 Sr\n0.913636 0.008894 0.276445 Sr\n0.086364 0.008894 0.776445 Sr\n0.589912 0.988372 0.722043 Sr\n0.395549 0.318158 0.890813 Cr\n0.103712 0.678650 0.109955 Cr\n0.896288 0.678650 0.609955 Cr\n0.604451 0.318158 0.390813 Cr\n0.551601 0.669905 0.516443 P\n0.051136 0.327580 0.984086 P\n0.948864 0.327580 0.484086 P\n0.448399 0.669905 0.016443 P\n0.212133 0.411234 0.336242 P\n0.787867 0.411234 0.836242 P\n0.290121 0.591730 0.663423 P\n0.709879 0.591730 0.163423 P\n0.563352 0.874348 0.404634 O\n0.062248 0.125363 0.096222 O\n0.937752 0.125363 0.596222 O\n0.436648 0.874348 0.904634 O\n0.415344 0.381905 0.029665 O\n0.917608 0.616248 0.470759 O\n0.082392 0.616248 0.970759 O\n0.584656 0.381905 0.529665 O\n0.688793 0.816486 0.200810 O\n0.189874 0.193324 0.295288 O\n0.810126 0.193324 0.795288 O\n0.311207 0.816486 0.700810 O\n0.632982 0.681636 0.048152 O\n0.132526 0.315300 0.450851 O\n0.867474 0.315300 0.950851 O\n0.367018 0.681636 0.548152 O\n0.615688 0.475110 0.850746 O\n0.117527 0.524255 0.651491 O\n0.882473 0.524255 0.151491 O\n0.384312 0.475110 0.350746 O\n0.651127 0.740714 0.595771 O\n0.151782 0.253128 0.906235 O\n0.624368 0.335289 0.235238 O\n0.348873 0.740714 0.095771 O\n0.375632 0.335289 0.735238 O\n0.869695 0.672445 0.764669 O\n0.130305 0.672445 0.264669 O\n0.848218 0.253128 0.406235 O\n","nsites":44,"nelements":4,"elements":["Sr","Cr","P","O"],"chemical_system":"Cr-O-P-Sr","density":3.5206938216106463,"density_atomic":0.07437928305201091,"volume":591.562572191403,"volume_molar":8.096529722918843,"formula_full":"Sr4 Cr4 P8 O28","formula_reduced":"SrCrP2O7","formula_anonymous":"ABC2D7","energy":-354.71085988000004,"energy_per_atom":-8.061610451818183,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-327.47885988,"band_gap":3.1321,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":16.0033072,"is_theoretical":true,"updated_at":"2021-11-28T01:38:21.445000Z","spacegroup":7},{"id":"mp-18207","created_at":"2022-09-04T14:39:27.523558Z","structure_string":"Sr4 Cr4 P8 O28\n1.0\n8.497906 0.000000 0.000000\n0.000000 5.475729 0.000000\n0.000000 5.406406 12.884398\nSr Cr P O\n4 4 8 28\ndirect\n0.171021 0.486054 0.225420 Sr\n0.671021 0.513946 0.274580 Sr\n0.828979 0.513946 0.774580 Sr\n0.328979 0.486054 0.725420 Sr\n0.138392 0.809575 0.895712 Cr\n0.861608 0.190425 0.104288 Cr\n0.638392 0.190425 0.604288 Cr\n0.361608 0.809575 0.395712 Cr\n0.288048 0.168566 0.519089 P\n0.788048 0.831434 0.980911 P\n0.711952 0.831434 0.480911 P\n0.211952 0.168566 0.019089 P\n0.971196 0.917533 0.327892 P\n0.528804 0.917533 0.827892 P\n0.028804 0.082467 0.672108 P\n0.471196 0.082467 0.172108 P\n0.290231 0.371613 0.407989 O\n0.790231 0.628387 0.092011 O\n0.709769 0.628387 0.592011 O\n0.209769 0.371613 0.907989 O\n0.173316 0.881541 0.032015 O\n0.673316 0.118459 0.467985 O\n0.826684 0.118459 0.967985 O\n0.326684 0.881541 0.532015 O\n0.442377 0.304347 0.210559 O\n0.942377 0.695653 0.289441 O\n0.557623 0.695653 0.789441 O\n0.057623 0.304347 0.710559 O\n0.391980 0.169139 0.057725 O\n0.891980 0.830861 0.442275 O\n0.608020 0.830861 0.942275 O\n0.108020 0.169139 0.557725 O\n0.355983 0.965223 0.844320 O\n0.855983 0.034777 0.655680 O\n0.644017 0.034777 0.155680 O\n0.144017 0.965223 0.344320 O\n0.392760 0.252417 0.591810 O\n0.892760 0.747583 0.908190 O\n0.399166 0.817481 0.242708 O\n0.107240 0.252417 0.091810 O\n0.100834 0.817481 0.742708 O\n0.600834 0.182519 0.757292 O\n0.899166 0.182519 0.257292 O\n0.607240 0.747583 0.408190 O\n","nsites":44,"nelements":4,"elements":["Sr","Cr","P","O"],"chemical_system":"Cr-O-P-Sr","density":3.473849073508163,"density_atomic":0.07338962619595953,"volume":599.5397753153078,"volume_molar":8.205711177653539,"formula_full":"Sr4 Cr4 P8 O28","formula_reduced":"SrCrP2O7","formula_anonymous":"ABC2D7","energy":-354.57013327,"energy_per_atom":-8.058412119772727,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-327.33813327,"band_gap":2.7137,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":16.0036555,"is_theoretical":false,"updated_at":"2021-11-28T01:34:35.018000Z","spacegroup":14},{"id":"mp-19508","created_at":"2022-09-04T14:47:59.422060Z","structure_string":"Sr4 Cr4 Si16 O40\n1.0\n7.558459 0.000000 0.000000\n0.000000 7.558459 0.000000\n0.000000 0.000000 15.855034\nSr Cr Si O\n4 4 16 40\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.000000 Sr\n0.500000 0.000000 0.587384 Cr\n0.000000 0.500000 0.912616 Cr\n0.000000 0.500000 0.412616 Cr\n0.500000 0.000000 0.087384 Cr\n0.175314 0.258598 0.651423 Si\n0.824686 0.741402 0.651423 Si\n0.258598 0.175314 0.848577 Si\n0.758598 0.324686 0.651423 Si\n0.241402 0.675314 0.651423 Si\n0.324686 0.758598 0.848577 Si\n0.675314 0.241402 0.848577 Si\n0.741402 0.824686 0.848577 Si\n0.324686 0.241402 0.348577 Si\n0.675314 0.758598 0.348577 Si\n0.241402 0.324686 0.151423 Si\n0.741402 0.175314 0.348577 Si\n0.258598 0.824686 0.348577 Si\n0.175314 0.741402 0.151423 Si\n0.824686 0.258598 0.151423 Si\n0.758598 0.675314 0.151423 Si\n0.257687 0.118122 0.586615 O\n0.742313 0.881878 0.586615 O\n0.118122 0.257687 0.913385 O\n0.618122 0.242313 0.586615 O\n0.381878 0.757687 0.586615 O\n0.242313 0.618122 0.913385 O\n0.757687 0.381878 0.913385 O\n0.881878 0.742313 0.913385 O\n0.242313 0.381878 0.413385 O\n0.757687 0.618122 0.413385 O\n0.381878 0.242313 0.086615 O\n0.881878 0.257687 0.413385 O\n0.118122 0.742313 0.413385 O\n0.257687 0.881878 0.086615 O\n0.742313 0.118122 0.086615 O\n0.252750 0.039651 0.367571 O\n0.618122 0.757687 0.086615 O\n0.752750 0.539651 0.632429 O\n0.460349 0.247250 0.867571 O\n0.960349 0.252750 0.632429 O\n0.039651 0.747250 0.632429 O\n0.252750 0.960349 0.867571 O\n0.747250 0.039651 0.867571 O\n0.539651 0.752750 0.867571 O\n0.712725 0.712725 0.250000 O\n0.787275 0.212725 0.250000 O\n0.212725 0.787275 0.250000 O\n0.287275 0.287275 0.250000 O\n0.787275 0.787275 0.750000 O\n0.712725 0.287275 0.750000 O\n0.287275 0.712725 0.750000 O\n0.212725 0.212725 0.750000 O\n0.960349 0.747250 0.132429 O\n0.752750 0.460349 0.132429 O\n0.247250 0.539651 0.132429 O\n0.460349 0.752750 0.367571 O\n0.539651 0.247250 0.367571 O\n0.039651 0.252750 0.132429 O\n0.747250 0.960349 0.367571 O\n0.247250 0.460349 0.632429 O\n","nsites":64,"nelements":4,"elements":["Sr","Cr","Si","O"],"chemical_system":"Cr-O-Si-Sr","density":3.020800948171654,"density_atomic":0.07065554863924355,"volume":905.8028878492507,"volume_molar":8.52323826787919,"formula_full":"Sr4 Cr4 Si16 O40","formula_reduced":"SrCr(Si2O5)2","formula_anonymous":"ABC4D10","energy":-533.0002336800001,"energy_per_atom":-8.328128651250001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-497.52423368,"band_gap":3.2707,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":16.1482636,"is_theoretical":false,"updated_at":"2021-11-28T01:38:23.933000Z","spacegroup":130},{"id":"mp-540583","created_at":"2022-09-04T14:41:29.635115Z","structure_string":"Sr4 Cr8 O16\n1.0\n5.186715 0.000006 -0.000019\n0.000007 6.031878 0.000016\n-0.000045 0.000032 11.748962\nSr Cr O\n4 8 16\ndirect\n0.858901 0.250005 0.749999 Sr\n0.141098 0.750007 0.250003 Sr\n0.544152 0.249990 0.249994 Sr\n0.455830 0.749998 0.750000 Sr\n0.504855 0.750005 0.007184 Cr\n0.495136 0.250001 0.992823 Cr\n0.999958 0.500087 0.499995 Cr\n0.999953 0.999904 0.499999 Cr\n0.504843 0.750023 0.492817 Cr\n0.495232 0.249993 0.507186 Cr\n0.000023 0.000000 0.000002 Cr\n0.000003 0.500004 0.999998 Cr\n0.838474 0.749995 0.407826 O\n0.838466 0.750006 0.092183 O\n0.161537 0.249998 0.592179 O\n0.161533 0.250008 0.907822 O\n0.172435 0.749993 0.585163 O\n0.172432 0.749996 0.914842 O\n0.827564 0.249998 0.414834 O\n0.827563 0.250000 0.085161 O\n0.663644 0.502862 0.594772 O\n0.663647 0.997121 0.905224 O\n0.336357 0.002880 0.405226 O\n0.336363 0.497117 0.094775 O\n0.336355 0.497117 0.405224 O\n0.336355 0.002879 0.094769 O\n0.663640 0.997132 0.594772 O\n0.663650 0.502882 0.905226 O\n","nsites":28,"nelements":3,"elements":["Sr","Cr","O"],"chemical_system":"Cr-O-Sr","density":4.618938249390691,"density_atomic":0.07617519913725496,"volume":367.57370268962063,"volume_molar":7.905644918826022,"formula_full":"Sr4 Cr8 O16","formula_reduced":"SrCr2O4","formula_anonymous":"AB2C4","energy":-237.85822770000004,"energy_per_atom":-8.49493670357143,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-210.8742277,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.1e-06,"is_theoretical":false,"updated_at":"2021-11-28T01:35:24.501000Z","spacegroup":59},{"id":"mp-1200664","created_at":"2022-09-04T14:39:08.909545Z","structure_string":"Sr4 Cr8 O40\n1.0\n14.997645 0.000000 0.000000\n0.000000 7.276327 0.000000\n0.000000 2.482636 8.589936\nSr Cr O\n4 8 40\ndirect\n0.382784 0.313341 0.806762 Sr\n0.882784 0.186659 0.193238 Sr\n0.617216 0.686659 0.193238 Sr\n0.117216 0.813341 0.806762 Sr\n0.629828 0.096682 0.787785 Cr\n0.129828 0.403318 0.212215 Cr\n0.370172 0.903318 0.212215 Cr\n0.870172 0.596682 0.787785 Cr\n0.358000 0.903498 0.598243 Cr\n0.858000 0.596502 0.401757 Cr\n0.642000 0.096502 0.401757 Cr\n0.142000 0.403498 0.598243 Cr\n0.268220 0.843487 0.170749 O\n0.768220 0.656513 0.829251 O\n0.731780 0.156513 0.829251 O\n0.231780 0.343487 0.170749 O\n0.439499 0.729007 0.216870 O\n0.939499 0.770993 0.783130 O\n0.560501 0.270993 0.783130 O\n0.060501 0.229007 0.216870 O\n0.400499 0.090238 0.073065 O\n0.900499 0.409762 0.926935 O\n0.599501 0.909762 0.926935 O\n0.099501 0.590238 0.073065 O\n0.371204 0.957255 0.393689 O\n0.871204 0.542745 0.606311 O\n0.628796 0.042745 0.606311 O\n0.128796 0.457255 0.393689 O\n0.251713 0.904339 0.639187 O\n0.751713 0.595661 0.360813 O\n0.748287 0.095661 0.360813 O\n0.248287 0.404339 0.639187 O\n0.407724 0.070675 0.658556 O\n0.907724 0.429325 0.341444 O\n0.592276 0.929325 0.341444 O\n0.092276 0.570675 0.658556 O\n0.399408 0.693853 0.687641 O\n0.899408 0.806147 0.312359 O\n0.600592 0.306147 0.312359 O\n0.100592 0.193853 0.687641 O\n0.462675 0.463629 0.502071 O\n0.962675 0.036371 0.497929 O\n0.537325 0.536371 0.497929 O\n0.037325 0.963629 0.502071 O\n0.225540 0.996867 0.955330 O\n0.725540 0.503133 0.044670 O\n0.774460 0.003133 0.044670 O\n0.274460 0.496867 0.955330 O\n0.478921 0.453300 0.057963 O\n0.978921 0.046700 0.942037 O\n0.521079 0.546700 0.942037 O\n0.021079 0.953300 0.057963 O\n","nsites":52,"nelements":3,"elements":["Sr","Cr","O"],"chemical_system":"Cr-O-Sr","density":2.4913824890202543,"density_atomic":0.055472550977153416,"volume":937.4005536795379,"volume_molar":10.856073236077142,"formula_full":"Sr4 Cr8 O40","formula_reduced":"SrCr2O10","formula_anonymous":"AB2C10","energy":-339.91329705000004,"energy_per_atom":-6.536794174038462,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-317.48129705,"band_gap":0.8811,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":15.9998952,"is_theoretical":true,"updated_at":"2021-11-28T01:34:35.201000Z","spacegroup":14},{"id":"mp-9660","created_at":"2022-09-04T14:39:19.558493Z","structure_string":"Sr4 Cu2 B4 O12\n1.0\n8.838737 0.000000 0.000000\n0.000000 5.874100 0.000000\n0.000000 2.821229 5.435690\nSr Cu B O\n4 2 4 12\ndirect\n0.605521 0.333708 0.837736 Sr\n0.105521 0.666292 0.662264 Sr\n0.394479 0.666292 0.162264 Sr\n0.894479 0.333708 0.337736 Sr\n0.500000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.249450 0.196340 0.159490 B\n0.750550 0.803660 0.840510 B\n0.250550 0.196340 0.659490 B\n0.749450 0.803660 0.340510 B\n0.690813 0.034317 0.316526 O\n0.190813 0.965683 0.183474 O\n0.662256 0.593927 0.385791 O\n0.837744 0.593927 0.885791 O\n0.162256 0.406073 0.114209 O\n0.337744 0.406073 0.614209 O\n0.592095 0.788935 0.819940 O\n0.092095 0.211065 0.680060 O\n0.407905 0.211065 0.180060 O\n0.907905 0.788935 0.319940 O\n0.809187 0.034317 0.816526 O\n0.309187 0.965683 0.683474 O\n","nsites":22,"nelements":4,"elements":["Sr","Cu","B","O"],"chemical_system":"B-Cu-O-Sr","density":4.194072391018195,"density_atomic":0.07795364966194772,"volume":282.2189864798476,"volume_molar":7.725283916937179,"formula_full":"Sr4 Cu2 B4 O12","formula_reduced":"Sr2Cu(BO3)2","formula_anonymous":"AB2C2D6","energy":-162.28609234,"energy_per_atom":-7.376640560909092,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-154.04209234,"band_gap":0.5013000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0013015,"is_theoretical":false,"updated_at":"2021-11-28T01:34:43.661000Z","spacegroup":14},{"id":"mp-555827","created_at":"2022-09-04T14:40:14.551907Z","structure_string":"Sr4 Cu2 Bi4 O12\n1.0\n2.762598 -12.722312 0.000000\n2.762598 12.722312 0.000000\n0.000000 0.000000 5.133052\nSr Cu Bi O\n4 2 4 12\ndirect\n0.574651 0.933536 0.500000 Sr\n0.933536 0.574651 0.000000 Sr\n0.066464 0.425349 0.000000 Sr\n0.425349 0.066464 0.500000 Sr\n0.500000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.662704 0.790424 0.000000 Bi\n0.209576 0.337296 0.500000 Bi\n0.790424 0.662704 0.500000 Bi\n0.337296 0.209576 0.000000 Bi\n0.748164 0.251836 0.250000 O\n0.748164 0.251836 0.750000 O\n0.599271 0.730278 0.500000 O\n0.624276 0.913209 0.000000 O\n0.086791 0.375724 0.500000 O\n0.269722 0.400729 0.000000 O\n0.375724 0.086791 0.000000 O\n0.251836 0.748164 0.250000 O\n0.251836 0.748164 0.750000 O\n0.730278 0.599271 0.000000 O\n0.913209 0.624276 0.500000 O\n0.400729 0.269722 0.500000 O\n","nsites":22,"nelements":4,"elements":["Sr","Cu","Bi","O"],"chemical_system":"Bi-Cu-O-Sr","density":6.928457216674172,"density_atomic":0.06097239946525657,"volume":360.81899667629267,"volume_molar":9.876830849393668,"formula_full":"Sr4 Cu2 Bi4 O12","formula_reduced":"Sr2Cu(BiO3)2","formula_anonymous":"AB2C2D6","energy":-134.7862218,"energy_per_atom":-6.126646445454545,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-126.5422218,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0125521,"is_theoretical":false,"updated_at":"2021-11-28T01:34:53.943000Z","spacegroup":66}]}