quantum-espresso/Doc

This is the available documentation for the Quantum-ESPRESSO package:

users-guide.tex    User's Guide for Quantum-ESPRESSO
                   Requires "html.sty" (from latex2html package): if
                   not available, comment "\usepackage{html}" and
                   uncomment "\def\htmladdnormallink#1#2{#1}" near the
                   beginning of the file.

README.XT3         Notes on I/O on Cray XT3 machines, by Axel Kohlmeyer
README.AUTOPILOT   Notes on the "autopilot" feature, by Targacept, Inc.
nomefile.upf       Naming convention for UPF pseudopotentials
                   The UPF format is described in ../upftools/UPF
restart            Describes the format of the new output data file
 
INPUT_CP         Input parameters for CP 
INPUT.HOWTO      Hints on how to choose simulation parameters for
                 CP with Car-Parrinello dynamics
INPUT_PW         Input parameters for PWscf (pw.x)
INPUT_PP         Input parameters for postprocessing (pp.x)
INPUT_PROJWFC    Input parameters for projection over atomic wfcs (projwave.x)
INPUT_DOS        Input parameters for density of state calculation (dos.x)
INPUT_PH         Input parameters for phonon calculations (ph.x)
INPUT_Gamma      Input parameters for normal-mode calculations (phcg.x)
INPUT_D3         Input parameters for 3rd-order derivatives (d3.x)
INPUT_EFG        Input parameters for electric-field gradient calc (efg.x)
INPUT_PWCOND     Input parameters for ballistic conductance (pwcond.x)

ChangeLog       ChangeLog for the Quantum-ESPRESSO suite after aug. 2004
                NO LONGER UPDATED: use script "cvs2cl.pl" in the main
                directory to get an updated ChangeLog from CVS
ChangeLog.pw    ChangeLog before aug 2004 for PWscf
ChangeLog.cp    ChangeLog before aug 2004 for CP

BUGS            List of bugs fixed - only bugs that have been present
                in some "official" release are listed
CREDITS         Who did what

pwscf.png, pwscf.eps, democritos.png, democritos.eps
                PWscf and DEMOCRITOS logos -- included from users-guide.tex

Documentation for the "atomic" pseudopotential generation code 
can be found in directory ../atomic_doc/

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.