yes, very simple. See http://chemapps.stolaf.edu/jmol/zip/Jmol.jar
On Tue, Jun 9, 2015 at 5:41 PM, Kubasik, Matt <mkuba...@fairfield.edu> wrote: > Dear Bob, > > Sometime between 14.1.14 and 14.2.14, the application's Gaussian export > tool broke. I think the break may correspond with moving the writing of > Gaussian input files from File>Export>Guassian... to Tools>Gaussian. > > The newer version of the Jmol app fails to enter the element symbol on the > molecular specification lines specifying symbol and cartesian coordinates. > (See below for a comparison of old and new). Should be an easy fix, I > think. > > Matt Kubasik > > The older versions of Jmol provided: > > # HF/3-21G** opt > > Title: Created by Jmol version 14.1.14_2014.04.14 2014-04-14 18:33 > > 0 1 > C -3.67066 -2.99556 -0.12826 > C -4.72502 -2.81040 0.76260 > C -5.57435 -1.71338 0.61745 > . > . > . > > > While newer version provides: > # HF/3-21G** opt > > Title: Created by Jmol version 14.2.14_2015.06.01 2015-06-01 19:39 > > 0 1 > 4.65903 2.67886 0.11173 > 5.71958 2.71145 -0.79054 > 6.38755 1.53364 -1.12385 > . > . > . > > > ------------------------------------------------------------------------------ > _______________________________________________ > Jmol-users mailing list > Jmol-users@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/jmol-users > -- Robert M. Hanson Larson-Anderson Professor of Chemistry Chair, Department of Chemistry St. Olaf College Northfield, MN http://www.stolaf.edu/people/hansonr 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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