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                       WANNIER90
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 The Maximally-Localised Generalised Wannier Functions Code 


 Wannier90 Version 2.0 has been written by: 
    Arash A. Mostofi   (Imperial College London, UK)
    Giovanni Pizzi     (EPFL, Switzerland)
    Ivo Souza          (Universidad del Pais Vasco, Spain)
    Jonathan R. Yates  (University of Oxford, UK)

 Contributors to the code include:
  Young-Su Lee (KIST, S. Korea) -- specialised Gamma point routines & transport
  Matthew Shelley (Imperial College London, UK) -- transport
  Nicolas Poilvert (Penn State University, USA) -- transport
  Raffaello Bianco (Univ. Pierre et Marie Curie Paris 6 and CNRS) -- 
    k-slice plotting
  Gabriele Sclauzero (ETH, Zurich, Switzerland) -- disentanglement
    in spheres in k-space
  David Strubbe (MIT, USA) -- various bugfixes/improvements

 w90vdw was written by:
   Lampros Andrinopoulos, Nicholas D. M. Hine and Arash A. Mostofi
 w90pov (povray plotting) was written by:
   Daniel Aberg (LLNL, USA)
 
We gratefully acknowledge Marco Buongiorno Nardelli for the dosqc
v1.0 subroutines for the calculation of the density of states and the
quantum transport, upon which transport.f90 is based. 

 Wannier90 Version 1.0 was written by:
    Arash A. Mostofi   (Imperial College London, UK)
    Jonathan R. Yates  (University of Oxford, UK)
    Young-Su Lee       (KIST, S. Korea)

 Wannier90 is based on Fortran 77 codes written by
               Nicola Marzari, Ivo Souza, David Vanderbilt

 website:  http://www.wannier.org


Directory Structure

doc/        Documentation including the user guide and a tutorial
examples/   Sample calculations from the tutorial
pseudo/     Pseudopotential files for sample calculations
utility/    Useful scripts and routines
src/        The Wannier90 source code
tests/      A set of tests to check Wannier90 is installed correctly
config/     Example make.inc for many platforms
pwscf/      Source files for the interface with Quantum-Espresso

For Installation Instructions see README.install
Further information can be found in the user guide and tutorial
                                                         
 Please cite                                             
                                                         
 [ref] A. A. Mostofi, J. R. Yates, Y.-S. Lee, I. Souza, D. Vanderbilt  
       and N. Marzari, "Wannier90: A Tool for Obtaining Maximally-Localised
       Wannier Functions", Computer Physics Communications 178, 685 (2008)

  in any publications arising from the use of this code.  

 For the method please cite 

 [ref] "Maximally Localized Generalised Wannier
        Functions for Composite Energy Bands"     
        N. Marzari and D. Vanderbilt              
        Phys. Rev. B 56 12847 (1997)              
                                                  
 [ref] "Maximally Localized Wannier Functions 
        for Entangled Energy Bands"
        I. Souza, N. Marzari and D. Vanderbilt    
        Phys. Rev. B 65 035109 (2001)             

 [ref] "Maximally localized Wannier functions: Theory and applications"
        Nicola Marzari, Arash A. Mostofi, Jonathan R. Yates, 
        Ivo Souza, David Vanderbilt 
        Rev. Mod. Phys. 84, 1419 (2012) 
                                                         

Copyright (c) 1996-2015, Arash A. Mostofi, Jonathan R. Yates,
  Young-Su Lee, Giovanni Pizzi, Ivo Souza,
  David Vanderbilt and Nicola Marzari

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.