Ab initio quantum chemical calculations have been performed to study the problemof dielectric polarization of molecules in solutions. It is shown that the theoretical resultsobtained for 2-pyrrolidinone molecules reproduce quite well the experimantal data at lowconcentrations.
Jul 29, 2014
May 21, 2014
|10.12921_cmst.1996.02.01.43-50_Gorb||Jul 29, 2014|