Dear all,
have you ever thought about the possibility to add an option to Jmol which adds extra atom following the z-matrix procedure? I don't know if I am clear to you let's say, for instance you have a surface of MgO an you want to "adsorb" a new atom on on of the Mg of the surface. you can define the postion of the new atom X in the following way : 1) distance of atom X to Mg 2) the angle between X-Mg and the next neighbor O 3) the torsional formed between X-Mg-O and a fourth atom for instance a fourth atom on the surface X X X | distance | angle | torsional Mg Mg-O Mg-O-Mg So would you be interested to add this option? To be honest I think this could boost up the cleverness of the new model-kit you had recently introduced . 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 mobile: +44 (0) 7772-9756456 ----------------------------------------------------------- ------------------------------------------------------------------------------ This SF.net email is sponsored by Sprint What will you do first with EVO, the first 4G phone? Visit sprint.com/first -- http://p.sf.net/sfu/sprint-com-first _______________________________________________ Jmol-developers mailing list Jmol-developers@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/jmol-developers
