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Input Format, Symmetry, Manipulation, Slabs, Nanotubes, Fullerenes, Helices
Hi Giu, it worked!
Good! The clean way is:
CRYSTAL 1 0 0 P 21/A
I guess the extra "1"s you put are safe as they correspond to the identity operator.
GiacomoAmbrogio
Dear Ambrogio,
Thank you so much! the problem has been perfectly solved.
All the best,
wang
Thank you Giacomo Ambrogio. I am greatful to the CRYSTAL code forum This will help alot.
Best Wishes
