Re: C3v symmetry

Posted by Roland Lindh on September 23, 1999 at 09:52:58:

In Reply to: C3v symmetry posted by Arantxa Irigoras on September 08, 1999 at 12:22:19:

: How can you define a C3v symetry molecule at SEWARD????

: Thanks in advance.

The molcas package is limited to D2h and subgroups. Hence C3v is
not explicitly an option.

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Comments:
: : How can you define a C3v symetry molecule at SEWARD???? : : Thanks in advance. : The molcas package is limited to D2h and subgroups. Hence C3v is : not explicitly an option.