[Wien] [WIEN] pairHess Error

Laurence Marks L-marks at northwestern.edu
Sun Apr 17 16:22:50 CEST 2011


Did you just ignore the error and run the scf iteration?

2011/4/17 SANJAY KUMAR SINGH <sanjayfizix at gmail.com>:
> Respected  Prof. L. Marks
> Sir,
> Thank you for your quick reply. Sir We are using very old version of Wien2k
> 9.1 on my server.
> Sir, Prof. M.Rajagopalan suggested that check your case.struct file, I
> checked it. Same case.struct file is running very well on another System.
> Sir, I am unable to resolve the problem please give me any suggestion on it.
> I will remain grateful to you.
> I am waiting for your reply.
>
> With kind regards and Thanks,
>
> SANJAY KUMAR SINGH
> JRF (DST), NEW DELHI
> CONDENSED MATTER THEORY GROUP
> SCHOOL OF STUDIES IN PHYSICS
> JIWAJI UNIVERSITY
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-- 
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60208, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
Web: www.numis.northwestern.edu
Chair, Commission on Electron Crystallography of IUCR
www.numis.northwestern.edu/
Research is to see what everybody else has seen, and to think what
nobody else has thought
Albert Szent-Gyorgi


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