forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

From: "hyello25 Qgrui" <hyello25@gmail.com>
To: forum@abinit.org
Subject: Re: [abinit-forum] question about high tolwfr before RF calculation
Date: Wed, 30 Jan 2008 12:35:55 +0800
Domainkey-signature: a=rsa-sha1; c=nofws; d=gmail.com; s=gamma; h=message-id:date:from:to:subject:in-reply-to:mime-version:content-type:references; b=aMarNkIj3eXSRx+dc2K2211HnwO5i/x11zlKy9jl2RtaswGdPm+ACFAqsKWcIy0jrteiMCzXLYu/jn0MMKJxfwRrsiL02lsd0cEzxLAG+1AsNl7ESfr22U5ZduEKidrjluvR3DwK4Hc3Mp3pTrSOFj9eVfaPfiz+FMsLqXeQmvs=

Hi,

Thanks for all your suggestions.

All these steps are quite effective, the WF now can easily achieve tolwfr<1.000E-21.

Bests.

Qian

question about high tolwfr before RF calculation, hyello25 Qgrui, 01/29/2008
- Re: [abinit-forum] question about high tolwfr before RF calculation, Anglade Pierre-Matthieu, 01/29/2008
  - Re: [abinit-forum] question about high tolwfr before RF calculation, hyello25 Qgrui, 01/29/2008
- Re: [abinit-forum] question about high tolwfr before RF calculation, Matthieu Verstraete, 01/29/2008
  - Re: [abinit-forum] question about high tolwfr before RF calculation, hyello25 Qgrui, 01/30/2008