ヤギ　トオル   YAGI TORU   八木　徹    所属   メディアコミュニケーション学部 情報文化学科    職種   教授
言語種別	英語
発行・発表の年月	1999/12
形態種別	論文
査読	査読あり
標題	Calculation of the parity-violating energy by using the generalized spin-orbitals obtained by the SCF calculation including the spin-orbit coupling interaction
執筆形態	共著
掲載誌名	JCPE journal
出版社・発行元	Japan Chemistry Program Exchange
巻・号・頁	11(3),pp.165-170
著者・共著者	◎Hiroshi Kiyonaga, Toru Yagi, Kenji Morihashi, Osamu Kikuchi
概要	The wavefunction was obtained by the SCF calculation in which the spin-orbit coupling (SOC) interaction was included variationally. This SOC-SCF wave function was used to calculate the parity-violating energy (Epv) of the glycine zwitterion.