[Wien] calculations of monoclinic and triclinic systems

[E.A.Moore]

There is no reason you should not do a calculation for monoclinic and triclinic systems. Look at the error message you have. Then check the User Guide and previous questions. Only after trying suggestions from there write to the mailing list with details of your files and error message.

Elaine A. Moore

________________________________
From: Nirpendra Singh [mailto:nsingh.phy at gmail.com]
Sent: 11 July 2010 12:58
To: wien-mailing
Subject: [Wien] calculations of monoclinic and triclinic systems

Dear all
              I am trying to do  the calculation for organic compounds having Monoclinic and triclic structures. Is it possible to do the calculation of these systems in wien2k. During init_lapw script, I am geeting error in x dstart.

suggestions are requested in this regard


with regards
nsingh

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