Dear wien2k developer
I am installing wien2k in ubuntu 11.0 operating system. I chose ifort and
cc compiler. I have given also installed mpich-3.0.3 and fftw 2.1.5 in the
system. I have compiled all the program and check the error message in
compile.msg for each program. I have found error in 12
Looks like you are using Wien2k 12.1.
Sequential Build
a) I see no "-DFFTW2" in your compiler options and "-lfftw" in your
R_LIB for fftw 2.1.5. So I assume you have used the patches to vresp.F
and fft_modules.F for the fftpack
[http://zeus.theochem.tuwien.ac.at/pipermail/wien/2012-November/0
Dear Gavin
Thanks for your reply. I am giving the details of the Makefile of the
SRC_lapw file.
SUFFIXES:.F
.SUFFIXES:.F90
SHELL = /bin/sh
FC = ifort
MPF = mpif90
CC = cc
FOPT = -FR -mp1 -w -prec_div -pc80 -pad -align -DINTEL_VML -traceback
FPOPT = $(FOPT) -DFFTW2
DParallel
3 matches
Mail list logo