Can you give me more details about (simple XYZ file format)
so the command will be
set appendNew false
DATA "model"
(Fe fx fy fz, O fx fy fz, etc. )
end "model"
On Thu, Nov 11, 2010 at 6:40 PM, P.Canepa <pc...@kent.ac.uk> wrote:
>
> -------------------------------------------
> From: Robert Hanson[SMTP:hans...@stolaf.edu <smtp%3ahans...@stolaf.edu>]
> Sent: Thursday, November 11, 2010 6:40:19 PM
> To: jmol-users@lists.sourceforge.net
> Subject: Re: [Jmol-users] add new atoms via Cartesian coordinates
> Auto forwarded by a Rule the simplest way to do it if you have several
> atoms to add is:
>
> set appendNew false
>
> and then
>
> DATA "model"
> (simple XYZ file format)
> end "model"
>
> We also have a new (undocumented) command ASSIGN that we use for the model
> kit.
>
> On Thu, Nov 11, 2010 at 10:45 AM, pieremanuele canepa <pc...@kent.ac.uk>wrote:
>
>> Dear All,
>>
>> Can you show me the Jmol command to add a new atom knowing its
>> fractional or Cartesian coordinates?
>>
>> Thanks a lot, 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
>> 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
> 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
>
--
*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
mobile: +44 (0) 7772-9756456
-----------------------------------------------------------
------------------------------------------------------------------------------
Centralized Desktop Delivery: Dell and VMware Reference Architecture
Simplifying enterprise desktop deployment and management using
Dell EqualLogic storage and VMware View: A highly scalable, end-to-end
client virtualization framework. Read more!
http://p.sf.net/sfu/dell-eql-dev2dev
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