Re: [Jmol-users] Problems with ACESII files

[Miguel <mt...@mt...>]

Victor,

Unfortunately, I am not familiar with most of the file format stuff in
Jmol. But I am sure that one of the other developers will get back to you=

within the next day or two.

Miguel

> Hello,
> I use jmol-5 with ACESII files but I have problems with visualization o=
f
> vibrational frequencies.  If I open the file ch3oh_ace.out from the
> jmol-5/samples directory it works fine, but I redid the frequency
> calculation for the same CH3-OH geometry and jmol fails to open the
> file.
>
> I don't have a problem visualizing frequencies from Gaussian98 output
> files.  I also do not have a problem reading ACESII output files from
> optimization runs.
>
> I use jmol-5 under RedHat 7.3, Java J2SDK 1.4.0
>
> Attached you'll find the gzipped output file that jmol-5 fails to read.=

>
> Thanx
>
>
> =3D=3D=3D=3D=3D
> Victor M. Rosas Garc=EDa
> Theoretical Chemistry Apprentice
>
> e-mail: quimico69=40yahoo.com
>
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