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pietrodelugas 7f4320ce07 wrong index in a do loop iat instead of istring
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@12577 c92efa57-630b-4861-b058-cf58834340f0
2016-07-08 15:21:00 +00:00
COUPLE make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
CPV Better definition of "nstep". What are ion_nstepe and cell_nstepe used for? 2016-07-01 09:10:31 +00:00
Doc Short and likely wrong summery of useful git commands added 2016-07-06 14:45:14 +00:00
EPW I introduced a bug by commenting lrdrho in the previous commit. 2016-07-06 18:37:54 +00:00
FFTXlib mispelled vailable do_fft_x -> do_fft_z in fft_scalar.FFTW.f90 2016-07-08 10:44:15 +00:00
GUI make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
GWW subroutine fft_dlay_set_dims introduced in fft_types in order to make sure desc%nr1... desc%nr3x are 2016-07-07 23:34:08 +00:00
LAXlib make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
LR_Modules make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
Modules wrong index in a do loop iat instead of istring 2016-07-08 15:21:00 +00:00
NEB make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
PHonon make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
PP Write Fermi energy into files containing the DOS (Sasha Fonari) 2016-06-25 08:04:21 +00:00
PW More ACE cleanup; parallelization on k-points should now work 2016-07-08 09:38:29 +00:00
PWCOND make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
PlotPhon Small bug (courtesy of Huiqun Zhou) 2010-10-18 13:25:32 +00:00
QHA QHA broken by format change 2014-04-09 11:14:35 +00:00
TDDFPT 1) make.sys is replaced by make.inc in TDDFPT/Examples 2016-06-26 17:34:04 +00:00
XSpectra make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
archive make.sys => make.inc 2016-06-25 07:44:21 +00:00
atomic make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
clib make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
dev-tools make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
include Cleanup of obsolete stuff in include/ - please note what is marked OBSOLESCENT 2016-05-19 12:35:41 +00:00
install I forgot two .inc in configure... sorry. 2016-07-01 11:17:31 +00:00
pseudo Added needed PP - it would be preferrable to use either an already available 2016-04-21 18:41:14 +00:00
test-suite Missing K_POINT card. Not really needed (Gamma is assumed) but better to add it 2016-07-08 15:05:54 +00:00
upftools make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
License O-sesame 2003-01-19 21:58:50 +00:00
Makefile make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
README Obsolete quote of Democritos as promoter of Quantum ESPRESSO 2016-06-17 12:54:16 +00:00
TODO make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
configure make.sys => make.inc. All other codes using make.sys should modify their build 2016-06-25 07:26:50 +00:00
environment_variables Reverted to original changes adopter to simplify local testing 2015-09-16 10:34:26 +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).

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 general documentation in directory Doc/, 
package-specific documentation in */Doc/, and the web site
http://www.quantum-espresso.org/

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.