Subject: Re: CCL:electrostatic potential

From: "Pablo Vitoria" <[email-masked]>
Date: Thu, 23 Mar 2000 12:00:05 +0100

Hi,

Molden, a freeware and constantly updated program that I have been using for
a while now (http://www.cmbi.kun.nl/~schaft/molden/molden.html), can display
Gaussian cubes, print them as Postscript (very nice plots!), and even export
them to POVRay, which produces high quality graphics.

gOpenMol (http://www.csc.fi/~laaksone/gopenmol/gopenmol.html) can do it
also, and you can even map the electrostac potential ont the density or any
other surface (two cubes: density and EP). The program comes with utilities
to transform Gaussian cubes to its own format.

Best regards

Pablo

-----------------------------------------
Pablo Vitoria Garcia
Dpto. Quimica Inorganica, Facultad de Ciencias
Universidad del Pais Vasco (UPV/EHU)
Aptdo. 644
E-48080 Spain

Phone: +34 94 6012000 Ext. 5529
Fax: +34 94 4648500
-----------------------------------------

----------
>From: Bernd Engels <[email-masked]>
>To: [email-masked] (Computational Chemistry List)
>Subject: CCL:electrostatic potential
>Date: juev., 11 mayo 1939 13:37
>

> Dear All,
>
> Somebody from here want to plot the electrostatic potential which he computed
> with G98 (gaussian cube file).
>
> Which plot program is the best.
>
> Bernd Engels
> Inst. f¸r Org. Chemie
> Universit”t W¸rzburg
>
>
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