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[abinit-forum] {Spam?} Consider the relativistic effect for heavy element within abinit.
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- From: Hongsheng Zhao <zhaohscas@yahoo.com.cn>
- To: "forum@abinit.org" <forum@abinit.org>
- Subject: [abinit-forum] {Spam?} Consider the relativistic effect for heavy element within abinit.
- Date: Sun, 28 Dec 2008 00:29:37 +0800
- Organization: Chinese Academy of Sciences
- Resent-date: Sat, 27 Dec 2008 17:29:42 +0100 (CET)
- Resent-from: Hongsheng Zhao <zhaohscas@yahoo.com.cn>
- Resent-message-id: <20081227162942.5EC60EA615@smtp1.sgsi.ucl.ac.be>
Dear users,
Currently I'm doing some research on the element Hf, a pretty heavy element.
If I want to take the relativistic effect into
account in my calculation. Is this possible within abinit? If so, what
parameters should I use for the input files? Any hints will be highly
appreciated. Thanks in advance.
Regards,
--
Hongsheng Zhao <zhaohscas@yahoo.com.cn>
Xinjiang Technical Institute of Physics and Chemistry
Chinese Academy of Sciences
GnuPG DSA: 0xD108493
2008-12-27
- [abinit-forum] {Spam?} Consider the relativistic effect for heavy element within abinit., Hongsheng Zhao, 12/27/2008
- Re: [abinit-forum] {Spam?} Consider the relativistic effect for heavy element within abinit., Luis DIAZ, 12/28/2008
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