excellent!
2009/7/15 Jan Halborg Jensen <[email protected]>
> "Robert Hanson" <[email protected]> skrev:
> > yes, absolutely. There are two ways:
> >
> > 1) use the ISOSURFACE command rather than the MO command.
>
> I have an example of option 1 here
> http://molecularmodelingbasics.blogspot.com/2009/07/ammonia-vsepr.html
>
> Jan
>
> > 2) load the model twice -- into two frames -- and then create MOs in
> each.
> >
> > There are slight differences in how that works.
> >
> > Bob Hanson
> >
> > On Tue, Jul 14, 2009 at 3:36 PM, Jörg Saßmannshausen <
> > [email protected]> wrote:
> >
> >> Dear all,
> >>
> >> I came across the possibility to use jmol for NBO visualisation and I
> got
> >> to
> >> say, I am very happy about that. Specially as you can turn the molecule
> you
> >> can get a very good view about the orbitals.
> >>
> >> What I was wondering is, however, is it possible to draw 2 orbitals
> (donor
> >> and
> >> acceptor) in one molecule?
> >> I tried the obvious combinations of mo 1; mo 2 and mo 1 mo 2 but somehow
> >> without success. Also, is it possible to have a different surface of the
> >> orbital, so not the mesh, rather like the pictures NOBView generates?
> >>
> >> All the best from Glasgow!
> >>
> >> Jörg
> >>
> >> --
> >> *************************************************************
> >> Jörg Saßmannshausen
> >> Research Fellow
> >> University of Strathclyde
> >> Department of Pure and Applied Chemistry
> >> 295 Cathedral St.
> >> Glasgow
> >> G1 1XL
> >>
> >> email: [email protected]
> >> web: http://sassy.formativ.net
> >>
> >> Please avoid sending me Word or PowerPoint attachments.
> >> See http://www.gnu.org/philosophy/no-word-attachments.html
> >>
> >>
> >>
> >>
>
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> >
> >
> >
> > --
> > Robert M. Hanson
> > Professor of Chemistry
> > St. Olaf College
> > 1520 St. Olaf Ave.
> > Northfield, MN 55057
> > http://www.stolaf.edu/people/hansonr
> > phone: 507-786-3107
> >
> >
> > If nature does not answer first what we want,
> > it is better to take what answer we get.
> >
> > -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
> >
>
> --------------------------------
>
>
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>
>
>
>
>
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--
Robert M. Hanson
Professor of Chemistry
St. Olaf College
1520 St. Olaf Ave.
Northfield, MN 55057
http://www.stolaf.edu/people/hansonr
phone: 507-786-3107
If nature does not answer first what we want,
it is better to take what answer we get.
-- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
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