CRYSTALS Contents+ Frequently Asked Questions + Crystals Primer + Crystals User Guide + Crystals Manual + Menu and toolbar + Getting Started + Crystals Worked Examples + IndexManuals built:
|
Cameron ManualChapter 5: Editing The Atom ListThe user is able to edit the names and elemental types of the atoms in the current list. The following commands are available - RENAME
The syntax is: RENAME at1 at2 or: RENAME el1 el2.
Arguments are entered in pairs - the first is renamed to the second - and must be like with like. i.e. you cannot rename an atom to an element or vice versa. RETYPE This allows the user to change the element of a list of atoms. ATOMS
The syntax is -
RETYPE element ATOM at1 at2 at3
|
© Copyright Chemical Crystallography Laboratory, Oxford, 2011. Comments or queries to Richard Cooper - richard.cooper@chem.ox.ac.uk Telephone +44 1865 285019. This page last changed on Wednesday 27 April 2011.