Subject: Help:Frozen calculation in g98

From: ��Ѹ�� <[email-masked]>
Date: Tue, 13 May 2003 20:11:23 +0800

Dear CCls：

	In g98,we can freezing one bond or angle by use  Opt=ModRedun .
	
	Here are two questions:
	    1. How to include a dumb atom in the frozen calculation?
	    2. Can the frozen calculation be done in Cartesian coordinates?

	Thank you for your help!　　　　　　　　
 				
　　　　　　　　　　　　　　Ding Xunlei
　　　　　　　　　　　　　　2003-05-13
______________________________________________
Ding Xunlei, Ph.D. Candidate
Open Laboratory of Bond Selective Chemistry
University of Science & Technology of China
Hefei, Anhui 230026, P.R.China
Tel.: 0086-551-3603418
Fax.: 0086-551-3602969
E-mail: [email-masked]
Http://www.bsc.ustc.edu.cn/~dxl