[Wien] Query on structure optimization

Mon Apr 16 12:18:17 CEST 2012

Dear Wien Users

In the w2web, there appear 7 options for optimizing a structure; in fact, there must be 8 according to the manual. As far as options 1-4 are concerned, one is able to enter the desired specific structure changes. But, how to manage with the rest of the options, for example, the option 7 for monoclinic lattice where one may wish to change a, b, c, and gamma all? I am not able to do so. Please advise.

Best regards

Sanjeev
-- 
Dr. Sanjeev Kumar Srivastava
Assistant Professor
Department of Physics
Indian Institute of Technology Kharagpur
Kharagpur 721302
India

Ph.:     0091-3222-283854 (Office)
         0091-3222-283855 (Residence)
Mobile:  0091-9735444091
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