12-25-2011
I'm not sure if this will help. I'm going to copy and paste the input line and what i get in return. It seems like it starts to open the program then gets held up for some reason.
zack@zack-PC ~
$ xcrysden
+----------------------------------------------------------------+
|****************************************************************|
|* *|
|* XCrySDen - (X-Window) CRYstalline Structures and DENsities *|
|* = === = === *|
|*--------------------------------------------------------------*|
|* *|
|* Anton Kokalj (Tone.Kokalj@ijs.si) *|
|* Jozef Stefan Institute, Ljubljana, Slovenia *|
|* *|
|* Copyright (c) 1996--2009 by Anton Kokalj *|
|* *|
|****************************************************************|
+----------------------------------------------------------------+
Version: 1.5.25
Please report bugs to: Tone.Kokalj@ijs.si
TERMS OF USE:
-------------
XCRYSDEN is released under the GNU General Public License.
Whenever graphics generated by XCRYSDEN are used in scientific
publications, it shall be greatly appreciated to include an explicit
reference. The preferred form is the following:
[ref] A. Kokalj, Comp. Mater. Sci., Vol. 28, p. 155, 2003.
Code available from http://www.xcrysden.org/.
XCRYSDEN_TOPDIR=/XCrySDen-1.5.25-bin-shared
XCRYSDEN_SCRATCH=/home/zack/xcrys_tmp
/XCrySDen-1.5.25-bin-shared/xcrysden: line 224: /XCrySDen-1.5.25-bin-shared/bin/ xcrys: cannot execute binary file
Thanks again for checking this out for me
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LEARN ABOUT DEBIAN
pwi2xsf
pwi2xsf(1) XCrySDen pwi2xsf(1)
NAME
pwi2xsf - convert the pw.x input file to XSF format
SYNOPSIS
pwi2xsf [-r] file
DESCRIPTION
pwi2xsf extracts the atomic structure from pw.x input file and prints the XSF formated 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.xcrys-
den.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 writen to file nuclei.charges.
The -r flag deletes this file as to force new ityp-->nat specification.
COPYRIGHT
Copyright (C) 1996--2012 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 MER-
CHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License for more details.
XCrySDen March 9, 2012 pwi2xsf(1)