NAME

       atoms - make lists of atomic coordinates from crystallographic data

SYNOPSIS

       atoms [-fu8gpsbaxF][-r#][-qvh][-tatptype-ofile]input_file

DESCRIPTION

       Take crystallographic data from the input file given on the command line and write output as indicated by
       their contents.  If no input file is given, F<atoms.inp> is used.  If the input  file  specified  at  the
       command  line is '-', then input is read from STDIN.  If no output format is specified, an input file for
       feff will be written.  Several command line switches can be used to override the contents  of  the  input
       files.

        output file flags
           -f    feff6 input file         -u    unit cell file
           -8    feff8 input file         -g    geometry file
           -p    P1 input file            -s    symmetry file
           -a    alchemy atoms list       -x    xyz atoms list
           -b    Protein Databank list
           -F    do not write feff file   -O    write to STDOUT
           -t s  user supplied template   -o f  output file name

        operational flags
           -r #  override the value of rmax with the given value
           -A    use a named file from the Atoms Database
           -q    suppress screen messages
           -v    write version information and exit
           -h    write this message and exit

                      # = number   f = file   s = string

       For complete information about Atoms, consult the documentation at:
       http://cars9.uchicago.edu/~ravel/software/doc/Atoms/

AUTHOR

       Atoms is copyright (c) 1998-2005 Bruce Ravel
       bravel@bnl.gov
       http://cars9.uchicago.edu/~ravel

                                                   May 1, 2006                                          ATOMS(1)