[Wien] how to convert the case.struct to a CIF file?

Laurence Marks L-marks at northwestern.edu
Sun May 6 03:00:49 CEST 2012


I meant "x struct2cif" (not a double t)

On Sat, May 5, 2012 at 8:00 PM, Laurence Marks <L-marks at northwestern.edu> wrote:
> "x sttruct2cif"
>
> On Sat, May 5, 2012 at 7:49 PM, Zhou Bing <umbingz at isl.ac.cn> wrote:
>> Dear all,
>>
>> I finished the optimization and obtained the new optimized structure, how
>> can I convert this structure to the corresponding CIF format?
>>
>> Thank you in advance!
>>
>> Best wishes,
>>
>> Bing
>>
>>
>>
>
>
>
> --
> Professor Laurence Marks
> Department of Materials Science and Engineering
> Northwestern University
> www.numis.northwestern.edu 1-847-491-3996
> "Research is to see what everybody else has seen, and to think what
> nobody else has thought"
> Albert Szent-Gyorgi



-- 
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu 1-847-491-3996
"Research is to see what everybody else has seen, and to think what
nobody else has thought"
Albert Szent-Gyorgi


More information about the Wien mailing list