WIEN2k

How to install and configure Wien2k in Ubuntu

Download from http://www.wien2k.at/index.html and save .tar file in a local directory (ie. home directory ~/wien)

1.

sudo apt-get install build-essentials

sudo apt-get install liblapack-dev

sudo apt-get install libblas-dev

2.

tar -xvf WIEN2k_09.tar (skip this if you downloaded files separately)

gunzip *.gz

chmod +x ./expand_lapw

./expand_lapw

./siteconfig_lapw

system: choose V gfortran+gotolib

compiler: gfortran and gcc

lib: R: -llapack_lapw -lblas_lapw -lblas -llapack

3.

./userconfig_lapw

...

...

...

remember, when the first time your do w2web, just press enter. Don't change the default user name and password. change them after you first set it up.