翻訳と辞書 |
INDO
INDO stands for Intermediate Neglect of Differential Overlap. It is a semi-empirical quantum chemistry method that is a development of the complete neglect of differential overlap (CNDO/2) method introduced by John Pople. Like CNDO/2 it uses zero-differential overlap for the two-electron integrals but not for integrals that are over orbitals centered on the same atom.〔J. Pople, D. L. Beveridge and P. A. Dobosh, Journal of Chemical Physics, 47, 2026, (1967)〕 The method is now rarely used in its original form with some exceptions〔Mudar A. Abdulsattar and Khalil H. Al-Bayati, ‘Corrections and parameterization of semiempirical large unit cell method for covalent semiconductors’, Phys. Rev. B 75, 245201 (2007).〕 but it is the basis for several other methods, such as MINDO, ZINDO and SINDO. ==See also==
*Computational chemistry
抄文引用元・出典: フリー百科事典『 ウィキペディア(Wikipedia)』 ■ウィキペディアで「INDO」の詳細全文を読む
スポンサード リンク
翻訳と辞書 : 翻訳のためのインターネットリソース |
Copyright(C) kotoba.ne.jp 1997-2016. All Rights Reserved.
|
|