[Wien] Error on V. Optimation

L. D. Marks L-marks at northwestern.edu
Tue Mar 28 23:15:15 CEST 2006


I assume that after the "PLEASE ENTER VALUE            1 (IN %)" you typed 
in a number (e.g. 5)? If you just did a carriage return, it's 
understandable that it died.

On Tue, 28 Mar 2006, Bagher Ahmadi wrote:

> Dear Prof. Blaha and wien2k user
>
>
> GENERATES STRUCT-FILES AND optimize.job
>
> PLEASE CHOOSE ONE OF THE FOLLOWING FEATURES:
>
>
>
> [1]  VARY VOLUME with CONSTANT RATIO A:B:C
>
> [2]  VARY C/A RATIO with CONSTANT VOLUME (tetr and hex lattices)
>
> [3]  VARY C/A RATIO with CONSTANT VOLUME and B/A (orthorh lattice)
>
> [4]  VARY B/A RATIO with CONSTANT VOLUME and C/A (orthorh lattice)
>
>
>
> ********************************************
>
>
>
> NUMBER OF STRUCTURE CHANGES ?
>
> PLEASE ENTER VALUE            1 (IN %)
>
>

Note: if you have an old email address for me, please note that "nwu" has
been changed to "northwestern".
-----------------------------------------------
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60201, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
http://www.numis.northwestern.edu
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