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- From: "Xiao Deng" <hydeng2007@gmail.com>
- To: "forum@abinit.org" <forum@abinit.org>
- Subject: About murn.f
- Date: Mon, 13 Nov 2006 13:43:46 +0800
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Dear Yu and Kamel Kassali,
Thanks for your kindly help!
However, according to the methods of Yu's effective a (Lattice constant) or Kamel Kassali's fixed c, the values of the c/a ratio or the c still couldn't be changed. During the fitting, I think, c/a ratio or the c could be changed. Therefore, I think, the a, b(=a) and c should be the fitted parameters instead of only unit cell volume. Am I right?
Xiao Deng
- About murn.f, Xiao Deng, 11/13/2006
- RE : [abinit-forum] About murn.f, kamel kassa, 11/15/2006
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