Dielectric screening in extended systems using the self-consistent Sternheimer equation and localized basis sets by Huebener, H, Perez-Osorio, M, Ordejon, P, Giustino, F

Performance of local orbital basis sets in the self-consistent Sternheimer method for dielectric matrices of extended systems by Huebener, H, Perez-Osorio, M, Ordejon, P, Giustino, F

Atomic structure of water monolayer on anatase TiO 2 (101) surface by Dette, C, Pérez-Osorio, M, Mangel, S, Giustino, F, Jung, S, Kern, K

Single-molecule vibrational spectroscopy of H2O on anatase TiO2 (101) by Dette, C, Pérez-Osorio, M, Mangel, S, Giustino, F, Jung, S, Kern, K

Vibrational properties of the organic inorganic halide perovskite CH3NH3PbI3 from theory and experiment: factor group analysis, first-principles calculations, and low-temperature i... by Perez-Osorio, M, Milot, R, Filip, M, Patel, J, Herz, L, Johnston, M, Giustino, F

TiO2 anatase with a bandgap in the visible region. by Dette, C, Pérez-Osorio, M, Kley, C, Punke, P, Patrick, C, Jacobson, P, Giustino, F, Jung, S, Kern, K

Electron-phonon coupling in hybrid lead halide perovskites by Wright, A, Verdi, C, Milot, R, Eperon, G, Pérez-Osorio, M, Snaith, H, Giustino, F, Johnston, M, Herz, L

First cycle voltage hysteresis in Li-rich 3d cathodes associated with molecular O2 trapped in the bulk by House, RA, Rees, G, Perez-Osorio, M, Marie, J-J, Boivin, E, Robertson, A, Nag, A, Garcia-Fernandez, M, Zhou, K-J, Bruce, P

Oxygen redox chemistry without excess alkali-metal ions in Na2/3[Mg0.28Mn0.72]O2 by Maitra, U, House, R, Somerville, J, Tapia-Ruiz, N, Lozano, J, Guerrini, N, Hao, R, Luo, K, Jin, L, Pérez-Osorio, M, Massel, F, Pickup, D, Ramos, S, Lu, X, McNally, D, Chadwick, A, Giustino, F, Schmitt, T, Duda, L, Roberts, M, Bruce, P