It's a typical problem with diffuse orbitals. The "scale" option to the MO
command gets you a bigger grid for that:
mo scale 2.0
mo 234
Bob
On Mon, Apr 30, 2012 at 4:34 AM, Olga Ershova <[email protected]>wrote:
> Dear users of Jmol,
>
> Maybe somebody will be able to help me, I would be very grateful.
> I am trying to visualize some diffuse molecular orbitals with Jmol,
> but I get them cropped, probably because their span is much larger
> than the distance between the nuclei. I attach a sample picture, not
> sure it will be sent though.
> Does anybody know if it is possible to change the boundaries of the
> depicted area? Is there a parameter defining its size?
>
> Thanks,
> Olga Ershova
>
>
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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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threat landscape has changed and how IT managers can respond. Discussions
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