Thanks a lot, Bob !
This is working nicely :-)
Best,
Max
On 13. 05. 13 00:13, Robert Hanson wrote:
OK, the Molden reader should work up to orbital type i. (Untested
past g.) Anything past f will be ignored. Assumptions here:
type spherical/cartesian: G 9/15, H 11/21, I 13/28 (all ignored)
supreme!
On Mon, May 13, 2013 at 5:13 AM, Angel Herráez angel.herr...@uah.es wrote:
Hello Jmolers
Saturday had an artistic flavor and today I am offering you a set of
new Jmol and JSmol logos or banners and an icon for the Jmol
application.
http://biomodel.uah.es/Jmol/logos/
If you
Very nice!!
Jaim
__
Dr Jaime Prilusky
Head Bioinformatics
RD Bioinformatics and Data Management
Department of Biological Services
Weizmann Institute of Science
76100 Rehovot - Israel
mail: jaime.prilu...@weizmann.ac.il
tel: 972-8-9344959
fax: 972-8-9344113
OCA, http://oca.weizmann.ac.il (the
On 13. 05. 13 12:38, Robert Hanson wrote:
My pleasure. It's a fix for 13.0 and 13.1.
:-)
It so comfortable to use the MO command from the console ;-)
A couple of chemistry questions:
Q: Why in this Fe(NCH)6 complex are there only 19 occupied orbitals?
They look great, but aren't there
He all,
may someone can tell me
how to use Jmol-13.0
behind a corporate firewall
which needs some authentication information
to reach out
and load molecule data from a remote molecule database.
I have added to the jmol.bat the following
@echo off
rem Set JMOL_HOME to the Jmol installation
This version does the energy sorting so that HOMO and LUMO work properly
http://chemapps.stolaf.edu/jmol/Jmol-13.zip
To NOT sort by energy, add FILTER NOSORT to the load command.
You can also select by symmetry using FILTER SYM=AU for example.
Robert M. Hanson
Larson-Anderson Professor of
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