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   准教授
言語種別 英語
発行・発表の年月 1999/12
形態種別 論文
査読 査読有り
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.