Article ID Journal Published Year Pages File Type
5384892 Chemical Physics Letters 2010 5 Pages PDF
Abstract
► Proton-ordered ices. ► DFT computations with periodic boundary conditions. ► The quantum-topological analysis of the electron density. ► IR intensities of localized, uncoupled OH stretching vibrations. ► Energies of the H-bonds and O⋯O interactions.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
, , ,