Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5384892 | Chemical Physics Letters | 2010 | 5 Pages |
Abstract
⺠Proton-ordered ices. ⺠DFT computations with periodic boundary conditions. ⺠The quantum-topological analysis of the electron density. ⺠IR intensities of localized, uncoupled OH stretching vibrations. ⺠Energies of the H-bonds and Oâ¯O interactions.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
M.V. Vener, A.N. Egorova, V.G. Tsirelson,