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- From: "Wu Rongqin" <g0203654@nus.edu.sg>
- To: <forum@abinit.org>
- Subject: about the convergence of pp
- Date: Thu, 8 Apr 2004 12:15:47 +0800
Dear all,
When I use the HGH pp to do calculation I find that it is very hard to get
converged, have you experienced such a matter?
Rongqin
-----Original Message-----
From: Masayoshi Mikami [mailto:mmikami@rc.m-kagaku.co.jp]
Sent: 2004年4月8日 10:38
To: forum@abinit.org
Subject: Re: [abinit-forum] About
Dear Wan,
As you like ... still, the following page also might be interesting:
The Orbitron:
a gallery of atomic orbitals and molecular orbitals on the WWW
http://www.shef.ac.uk/chemistry/orbitron/
and the reference page therein:
http://www.shef.ac.uk/chemistry/orbitron/admin/references.html
Regards,
Masayoshi
On 2004/04/08, at 10:38, ccmp@nju.edu.cn wrote:
> Dear All.
>
> How I can plot the 3D-picture of the atomic orbital, such as d
> orbital, p orbital? Which software can do it?
>
> Thanks
>
> Wan
>
- about the convergence of pp, Wu Rongqin, 04/08/2004
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