Hi Craig,

over the last couple of years I have written a program (convert) that
converts all kinds of files
from one format to another, including ADF-input/output to XYZ
files/ADF-input files/movie-files;
the XYZ-file can then be read by viewer programs like iMol,
WebLabViewer, Molekel, etc.
however, it was written in F77, and has been adapted many many times
according to my needs at certain
periods in time; therefore, at present it's kinda messy..

Currently I am working on transforming it to F90 (the program has been
renamed to msc, cuz convert
is already present at many UNIX systems), and making it general.
Unfortunately, it is only version 0.1,
and the only in/output options are angs/z-mat, I'll add the ADFoutput
reading option, but it may take some time.
The program (and more info) are available at:

http://theochem.chem.rug.nl/~swart/manuals/msc/

On Wednesday, May 21, 2003, at 10:31 Europe/Amsterdam, C.A.Sams wrote:

> Hi
>
> We have recently purchased a copy of ADF along with the graphical user
> interface. We have been using ADFinput to build the molecules and then
> run
> geomtry optimizations, however we were wondering if there was a way to
> visualize the output, i.e the optimized geometry. I have been
> informed that
> some people have written there own scripts to enable them to do this.
> How is
> this done?
>
> Regards
>
> Craig Sams
>
>
–––––––––––––––––––––––––––––––––––––
Marcel Swart

Organische en Anorganische Chemie
Faculteit der Exacte Wetenschappen
Vrije Universiteit Amsterdam

De Boelelaan 1083
1081 HV Amsterdam
The Netherlands

F +31-(0)20-4447488
E swart_at_chem.vu.nl
W http://go.to/m.swart
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Received on 2003-05-21 10:46:08