Re: [Jmol-users] new web page displays orbitals

[Robert H. <ha...@st...>]

They mean something? ;)

On Thu, Mar 24, 2011 at 9:20 AM, Greeves, Nick <ngr...@li...>wrote:

> Very nice Bob,
> Especially the listing with pictures of all the orbitals and the like to
> the Jmol window for 3D.
> The trouble comes when we have to explain what they all mean!
> All the best
> Nick
> --
> 3D Organic Animations     http://www.chemtube3d.com
> Tel:             +44 (0)151-794-3506 (3500 secretary)
>
>
>
> On 24 Mar 2011, at 13:43, <jmo...@li...> <
> jmo...@li...> wrote:
>
> Message: 4
> Date: Thu, 24 Mar 2011 08:43:43 -0500
> From: Robert Hanson <ha...@st...>
> Subject: [Jmol-users] new web page displays orbitals
> To: jmo...@li...
> Message-ID:
>        <AANLkTi=+RD...@ma...>
> Content-Type: text/plain; charset="iso-8859-1"
>
> I have put up a new web page that uses some very recent capabilities of
> Jmol
> 12.1.41.
>
> http://chemapps.stolaf.edu/jmol/docs/examples-12/motest/
>
> Specifically, you can:
>
> -- drag/drop any Spartan file or QM output into the applet from your
> computer.
> -- select and display a molecular orbital from a drop-down list
> -- select and display a linear combination of MOs
> -- create a vertical list of MO images that can be clicked on to activate
> in
> Jmol or to save
>
> New features utilized:
>
> -- MO [....] linear combination option
> -- better control over refreshing and image creation (locks out mouse and
> system refreshing)
> -- jmolGetPropertyAsString("image","height=... width=...")  height/width
> option
>
>
>
>
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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