Mikhail V. Vener

Intermolecular hydrogen bond energies in crystals evaluated using electron density properties: DFT computations with periodic boundary conditions

Mikhail V. Vener, Andrei V. Churakov, Vladimir G. Tsirelson · Journal of Computational Chemistry · 2012 · 286 citations · Full text

How Strong Is Hydrogen Bonding in Ionic Liquids? Combined X-ray Crystallographic, Infrared/Raman Spectroscopic, and Density Functional Theory Study

Sergey A. Katsyuba, Mikhail V. Vener, Elena E. Zvereva et al. · The Journal of Physical Chemistry B · 2013 · 143 citations · Full text

The infrared spectrum of the O⋯H⋯O fragment of H5O2+: <i>Ab initio</i> classical molecular dynamics and quantum 4D model calculations

Mikhail V. Vener, Oliver Kühn, Joachim Sauer · The Journal of Chemical Physics · 2001 · 119 citations

Engineering, Strong Hydrogen Bonds, Computational Chemistry +21

QTAIM Study of Strong H-Bonds with the O−H···A Fragment (A = O, N) in Three-Dimensional Periodical Crystals

Mikhail V. Vener, A. V. Manaev, Vladimir G. Tsirelson · The Journal of Physical Chemistry A · 2007 · 115 citations

Topological Properties, Crystal Structure, Electron Density Rhob +22

Theoretical study of hydrogen bonding and proton transfer in the ground and lowest excited singlet states of tropolone

Mikhail V. Vener, Steve Scheiner, N. D. Sokolov · The Journal of Chemical Physics · 1994 · 95 citations

Engineering, Nuclear Physics, Proton-coupled Electron Transfer +18