str2xyz

Utility to convert structure files into xyz files suitable for viewing with rasmol
Syntax: str2xyz [-v] na nb nc [scale] infile
-v (optional) calls rasmol (otherwise, xyz file is written to stdout
na nb nc define the number of periodic repetition to plot
scale (optional) scales the structure to adjust which bonds are plotted


avdw@alum.mit.edu Sat, Jun 21, 2025 12:31:12 AM