CCL:G: Fixing coordinate system in Gaussian



 Sent to CCL by: Duy Le [ttduyle**gmail.com]
 It is better this way so that Gaussian can improve speed of
 calculation due to some needed geometry operations. Writing a tiny
 code to translate it (if necessary) will be the cheaper. :-)
 On Thu, Apr 9, 2009 at 11:53 AM, Mike Clark mike.clark28#%#yahoo.co.uk
 <owner-chemistry],[ccl.net> wrote:
 >
 > Sent to CCL by: "Mike  Clark" [mike.clark28{}yahoo.co.uk]
 > Hi all
 >
 > I am trying to do a single point calculation in Gaussian, the input is in
 cartesian coordinates, but the definition for the coordinate system are
 translated/rotated in the results file, is there anyway to force gaussian to use
 the fix input coordinates, while its possible to convert the results to the
 origin coordinates its just seems alot of unnecessary work, there must be an
 easier way to do this.
 >
 > Best
 >
 > Mike Clark
 >
 >
 >
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