화학공학소재연구정보센터
검색결과 : 7건
No. Article
1 A second generation multistate empirical valence bond model for proton transport in aqueous systems
Day TJF, Soudackov AV, Cuma M, Schmitt UW, Voth GA
Journal of Chemical Physics, 117(12), 5839, 2002
2 A multi-state empirical valence bond model for weak acid dissociation in aqueous solution
Cuma M, Schmitt UW, Voth GA
Journal of Physical Chemistry A, 105(12), 2814, 2001
3 Comparison of methods for calculating the properties of intramolecular hydrogen bonds. Excited state proton transfer
Kar T, Scheiner S, Cuma M
Journal of Chemical Physics, 111(3), 849, 1999
4 Structure, stability, and bonding of BC2N : An ab initio study
Kar T, Cuma M, Scheiner S
Journal of Physical Chemistry A, 102(49), 10134, 1998
5 Competition between rotamerization and proton transfer in o-hydroxybenzaldehyde
Cuma M, Scheiner S, Kar T
Journal of the American Chemical Society, 120(40), 10497, 1998
6 Excited state intramolecular proton transfer in anionic analogues of malonaldehyde
Scheiner S, Kar T, Cuma M
Journal of Physical Chemistry A, 101(33), 5901, 1997
7 Relative Stability of Hydrogen and Deuterium Bonds
Scheiner S, Cuma M
Journal of the American Chemical Society, 118(6), 1511, 1996