- 著者
-
Insook Park
Yun Hee Jang
Sungu Hwang
Doo Soo Chung
- 出版者
- (社)日本化学会
- 雑誌
- Chemistry Letters (ISSN:03667022)
- 巻号頁・発行日
- vol.32, no.4, pp.376-377, 2003 (Released:2003-03-25)
- 参考文献数
- 16
- 被引用文献数
-
4
A Poisson–Boltzmann continuum solvation model coupled with ab initio quantum calculation was developed for 1-octanol. It was applied to the calculation of the solvation free energies of various solutes consisting of C, H, and O in 1-octanol and their 1-octanol/water partition coefficients.