yes but it doesn't change the cell parameters. Do you know what I mean
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Pieremanuele Canepa
Room 104
Functional Material Group
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University of Kent, Canterbury, Kent,
CT2 7NH
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e-mail: pc...@kent.ac.uk
mobile: +44 (0) 7772-9756456
-----------------------------------------------------------
________________________________________
From: Robert Hanson [hans...@stolaf.edu]
Sent: Friday, September 17, 2010 5:01 PM
To: jmol-developers@lists.sourceforge.net
Subject: Re: [Jmol-developers] supercell option
load "" {2 2 2}
works just fine, right?
Bob
On Fri, Sep 17, 2010 at 2:04 AM, P.Canepa
<pc...@kent.ac.uk<mailto:pc...@kent.ac.uk>> wrote:
Dear all,
could be possible to add an option to re-set the dimensions of the cell once
you the original cell is manipulated?
For instance load "" { 2 2 2} ; the command could be setSupercell ?
So then when the structure is esported both the coordinate and the cell
parameters are correctely exported.
Thanks, Piero
--
Please consider the environment before printing this e-mail.
Pieremanuele Canepa
Room 104
Functional Material Group
School of Physical Sciences, Ingram Building,
University of Kent, Canterbury, Kent,
CT2 7NH
United Kingdom
e-mail: pc...@kent.ac.uk<mailto:pc...@kent.ac.uk>
mobile: +44 (0) 7772-9756456
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Robert M. Hanson
Professor of Chemistry
St. Olaf College
1520 St. Olaf Ave.
Northfield, MN 55057
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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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Start uncovering the many advantages of virtual appliances
and start using them to simplify application deployment and
accelerate your shift to cloud computing.
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