Alex Granovsky
gran@classic.chem.msu.su
no, this is impossible.
Kind regards,
Alex
On Thu Jan 14 '16 7:51pm, GrEv wrote
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>Dear All,
>I would like to freeze atoms completely, avoiding use of the keyword IFREEZ.
>There is the keyword IFRZAT, which freezes all the distances between
>the specified atoms. However, the atoms frozen with IFRZAT still can rotate as a whole
>with respect to the other atoms. I am wondering how one can suppress also
>this degree of freedom. (For example, one could freeze the distance from the origin to
>the atoms specified in IFRZAT. Is that possible?)
>Many thanks!
>Evgeniy