[Wien] A tiny bug in WIENNCM

[Hongjun Xiang]

Dear WIENNCM users and developers,
 I found a bug related to the visualization of magnetism.
Line 195 of "dataexp.f" in SRC_struct2mol
qq=qq*180.0d0/pi
should be deleted.
I think qq should not be converted into the degree unit before sin and cos
calculations.

Thank you.

Best regards,
Hongjun Xiang

-- 
Best regards,
Hongjun Xiang

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H. J. Xiang
Postdoctoral Research Associate
Department of Chemistry
North Carolina State University
Raleigh, NC 27695-8204
Tel: 001-919-515-8919
http://www4.ncsu.edu/~hxiang/
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