WIEN2k 12.1 (Release 22/7/2012)


Directory list:

VersionDescription
build01 WIEN2k 12.1 (Release 22/7/2012) build01
build02 WIEN2k 12.1 (Release 22/7/2012) build02
tst WIEN2k 12.1 (Release 22/7/2012) build01

Level of support

Tier 1 NSC has at least one application expert on staff with knowledge about this software, and we will try to help you with any problems. We have also ran some internal tests to make sure that the program is working as intended. NSC also commits to installing updates to this program as they become available.

Please see the page describing our software support categories for more information.
You can also contact support@nsc.liu.se for further information.

This is version 12.1 of WIEN2k. It is considered an IMPORTANT UPDATE from previous versions.

The source files and examples provided in /SRC* can be found in build01.

FFTW3 was compiled separately for use within WIEN2k by:

module load intel/12.1.4 openmpi/1.6.2-build1 mkl/10.3.10.319
./configure --enable-mpi --prefix=/software/apps/wien2k/12.1/fftw/3.3.2 CC=icc MPICC="icc -Nmpi" CXX=icpc FC=ifort F77=ifort CFLAGS=-O2 FCFLAGS=-O2 CXXFLAGS=-O2 FFLAGS=-O2
make; make install