[Pw_forum] I can't view the output file of relax calculation using Xcrysden step by step.

[vega lew]

Thank you all.
I'll try it immediately.

vega

On Mon, Dec 8, 2008 at 5:53 PM, Axel Kohlmeyer
<akohlmey at cmm.chem.upenn.edu>wrote:

> On 12/8/08, vega lew <quantumdft at gmail.com> wrote:
> > Dear sir,
> >
> > I used XCrySDen-1.4.1bin-static. Is this the latest version? If not,
> could
> > you please give me the link to it?
>
> how about checking the xcrysden homepage?
> it is a simple as that. in this case you'd find:
> http://www.xcrysden.org/News.html#dec05-2008
>
> which will answer your question.
>
> axel.
>
> >
> > thank you for reading.
> >
> > vega
> >
> > On Mon, Dec 8, 2008 at 4:50 PM, Paolo Giannozzi
> > <giannozz at democritos.it>wrote:
> >
> >>
> >> On Dec 8, 2008, at 5:22 , vega lew wrote:
> >>
> >> > When I want to visualize the process of the relaxation, I found
> >> > only last / initial configuration displayed. I can't visualize the
> >> > output file step by step.
> >> > Did anyone encounter the same problem using 4.0.3 version of QE?
> >>
> >> did you try with a more recent version of xcrysden?
> >>
> >> Paolo
> >> ---
> >> Paolo Giannozzi, Democritos and University of Udine, Italy
> >>
> >>
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> >>
> >
> >
> >
> > --
> >
> ==================================================================================
> > Vega Lew ( weijia liu)
> > PH.D Candidate in Chemical Engineering
> > State Key Laboratory of Materials-oriented Chemical Engineering
> > College of Chemistry and Chemical Engineering
> > Nanjing University of Technology, 210009, Nanjing, Jiangsu, China
> >
> ******************************************************************************************************************
> > Email: vegalew at gmail.com
> > Office: Room A705, Technical Innovation Building, Xinmofan Road 5#,
> Nanjing,
> > Jiangsu, China
> >
> ******************************************************************************************************************
> >
>
>
> --
> =======================================================================
> Axel Kohlmeyer   akohlmey at cmm.chem.upenn.edu   http://www.cmm.upenn.edu
>  Center for Molecular Modeling   --   University of Pennsylvania
> Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323
> tel: 1-215-898-1582,  fax: 1-215-573-6233,  office-tel: 1-215-898-5425
> =======================================================================
> If you make something idiot-proof, the universe creates a better idiot.
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-- 
==================================================================================
Vega Lew ( weijia liu)
PH.D Candidate in Chemical Engineering
State Key Laboratory of Materials-oriented Chemical Engineering
College of Chemistry and Chemical Engineering
Nanjing University of Technology, 210009, Nanjing, Jiangsu, China
******************************************************************************************************************
Email: vegalew at gmail.com
Office: Room A705, Technical Innovation Building, Xinmofan Road 5#, Nanjing,
Jiangsu, China
******************************************************************************************************************
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