The RISM method for estimating the thermodynamic characteristics of hydration of molecules

Authors
Tikhonov, DA Tsygankova, IG Golovanov, IB
Citation
Da. Tikhonov et al., The RISM method for estimating the thermodynamic characteristics of hydration of molecules, RUSS J PH C, 73(10), 1999, pp. 1640-1645
Citations number
22
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY
ISSN journal
00360244 → ACNP
Volume
73
Issue
10
Year of publication
1999
Pages
1640 - 1645
Database
ISI
SICI code
0036-0244(199910)73:10<1640:TRMFET>2.0.ZU;2-5
Abstract
The RISM method was applied to calculate the Gibbs free energy of hydration for several systems studied earlier. A comparison of the obtained and lite rature data allowed us to draw conclusions about the potentialities and lim itations of the RISM method.