Computationally Assisted Identification of Functional Inorganic Materials

M. S. Dyer, C. Collins, D. Hodgeman, P. A. Chater, A. Demont, S. Romani, R. Sayers, M. F. Thomas, J. B. Claridge, G. R. Darling, M. J. Rosseinsky
2013 Science  
This PDF file includes: Materials and Methods • Calculations • Synthesis • Diffraction • Mössbauer spectroscopy • Titrations to determine oxygen content • Electron microscopy • Solid oxide fuel cell cathode processing and measurement o DC conductivity o AC impedance o Thermal stability Supplementary Text • Stability of 16a p phase • Searching a phase diagram • Extracting information from ranked structures Figs. S1 to S13 Table S1
doi:10.1126/science.1226558 pmid:23579498 fatcat:btkjlfsefvfnzeilyfwgye6yua