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ccavazzoni 768f2432e2 - again verbosity
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5871 c92efa57-630b-4861-b058-cf58834340f0
2009-08-30 09:49:48 +00:00
CPV - again verbosity 2009-08-30 09:49:48 +00:00
D3 Removed SHMEM, Makefiloes and make.depend updated; lenght => length ; misc 2009-08-04 14:34:32 +00:00
Doc Removed SHMEM, Makefiloes and make.depend updated; lenght => length ; misc 2009-08-04 14:34:32 +00:00
EE Removed SHMEM, Makefiloes and make.depend updated; lenght => length ; misc 2009-08-04 14:34:32 +00:00
GIPAW Nicer output. (D.C.) 2009-08-14 16:13:56 +00:00
GUI the following tabs were renamed: 2009-08-05 10:42:31 +00:00
GWW removed obsolete (and useless anyway) include f_defs.h 2009-08-22 21:10:17 +00:00
Gamma Removed SHMEM, Makefiloes and make.depend updated; lenght => length ; misc 2009-08-04 14:34:32 +00:00
Modules - duplicated subroutines removed 2009-08-23 09:06:08 +00:00
Multigrid Unused routine removed 2009-03-25 08:53:12 +00:00
PH Minor changes to allow calculations with local potentials only 2009-08-23 10:38:29 +00:00
PP Formally uncorrect (although usually harmless) array size removed 2009-08-21 14:41:58 +00:00
PW - fix of recent update 2009-08-29 21:44:09 +00:00
PWCOND Removed SHMEM, Makefiles and make.depend updated; lenght => length ; misc 2009-08-04 14:36:12 +00:00
VdW Removed SHMEM, Makefiles and make.depend updated; lenght => length ; misc 2009-08-04 14:36:12 +00:00
XSpectra Removed SHMEM, Makefiles and make.depend updated; lenght => length ; misc 2009-08-04 14:36:12 +00:00
atomic More of the same 2009-08-03 08:15:09 +00:00
atomic_doc Added NLCC to N pseudopotential. 2009-03-25 15:26:05 +00:00
clib More of the same... 2009-08-01 20:55:14 +00:00
dev-tools Packaging updated and simplified a little bit - now "make doc" makes pdf 2009-07-22 13:32:58 +00:00
doc-def The explanation of the ph.x grid splitting updated. 2009-07-30 16:11:14 +00:00
examples recommit run_example stuff for example03 2009-08-08 09:19:54 +00:00
flib More standardization to the "Quantum ESPRESSO" form 2009-08-01 20:50:09 +00:00
include Removed SHMEM, Makefiles and make.depend updated; lenght => length ; misc 2009-08-04 14:36:12 +00:00
install Misspell corrected 2009-08-21 15:44:02 +00:00
pseudo Added pseudo needed by GWW examples 2009-08-08 08:57:31 +00:00
pwtools Small change to the installation mechanism: the list of locations for 2009-07-22 17:18:42 +00:00
tests Forgot this one 2009-07-17 09:14:14 +00:00
upftools More of the same... 2009-08-01 21:02:07 +00:00
License O-sesame 2003-01-19 21:58:50 +00:00
Makefile Option gww calculation added to QE Makefile 2009-08-07 12:01:55 +00:00
README Doc + configure update 2007-11-21 15:49:25 +00:00
TODO Better (or less bad) configure support for openmp 2009-07-29 15:05:15 +00:00
cl2html.pl "make log" produces a ChangeLog file: bug fixed, html format added 2005-06-20 12:33:53 +00:00
config.guess More minor tweaking: obsolete or useless variables removed, 2006-09-21 20:07:55 +00:00
config.sub added autoconf-based configure (file "configure.new") and related files 2003-11-13 13:35:10 +00:00
configure Misspell corrected 2009-08-21 15:44:02 +00:00
configure.ac Misspell corrected 2009-08-21 15:44:02 +00:00
configure.msg.in - better support for SCALAPACK library. 2009-08-20 13:24:31 +00:00
cvs2cl.pl "make log" produces a ChangeLog file: bug fixed, html format added 2005-06-20 12:33:53 +00:00
ifcmods.sh More miscellanous cleanup from Axel: 2006-12-12 11:02:09 +00:00
includedep.sh More miscellanous cleanup from Axel: 2006-12-12 11:02:09 +00:00
install-sh added autoconf-based configure (file "configure.new") and related files 2003-11-13 13:35:10 +00:00
make.sys.in - better support for SCALAPACK library. 2009-08-20 13:24:31 +00:00
makedeps.sh added dependencies search for GWW in makedeps.sh 2009-08-07 12:03:16 +00:00
moduledep.sh More miscellanous cleanup from Axel: 2006-12-12 11:02:09 +00:00
namedep.sh More miscellanous cleanup from Axel: 2006-12-12 11:02:09 +00:00

README

This is the distribution of the Quantum-ESPRESSO suite of codes (ESPRESSO: 
opEn-Source Package for Research in Electronic Structure, Simulation, 
and Optimization), promoted by the DEMOCRITOS National Simulation Center 
of the Italian INFM (http://www.democritos.it). 

Quick installation instructions for the impatient:
   ./configure [options]
   make all
("make" alone prints a list of acceptable targets). Binaries go in bin/.
For more information, see the documentation contained in directory Doc/,
consult the web site http://www.quantum-espresso.org/ and in particular
the Wiki page http://www.quantum-espresso.org/wiki/index.php/Main_Page .

All the material included in this distribution 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.

These programs are distributed in the hope that they 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.

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.,
675 Mass Ave, Cambridge, MA 02139, USA.