NAME

       pwi2xsf - convert the pw.x input file to XSF format

SYNOPSIS

       pwi2xsf [-r] file

DESCRIPTION

       pwi2xsf  extracts  the  atomic  structure from pw.x or neb.x input file and prints the XSF
       formatted structure data to standard output.  It is a utility program of xcrysden  package
       (http://www.xcrysden.org/)   and   XSF   is   the   native   xcrysden   structure   format
       (http://www.xcrysden.org/doc/XSF.html).

       If file is specified as "-" then standard input is read.

OPTION

       -r  For old pw.x versions < 1.2  one  must  spefify  the  ityp-->nat  conversion  and  the
           corresponding  data  are written to file nuclei.charges. The -r flag deletes this file
           as to force new ityp-->nat specification.

COPYRIGHT

       Copyright (C) 1996--2019 Anton Kokalj

       This program is free software; you can redistribute it and/or modify it under the terms of
       the  GNU  General  Public  License  as  published  by the Free Software Foundation; either
       version 2 of the License, or (at your option) any later version.  You should have received
       a  copy  of  the  GNU General Public License along with this program; if not, write to the
       Free Software Foundation, Inc., 59 Temple Place - Suite 330, Boston, MA 02111-1307, USA.

       This program is distributed in the hope that it will be useful, but WITHOUT ANY  WARRANTY;
       without  even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.
       See the GNU General Public License for more details.