[gpaw-users] Test GAPW

fabio.lima fabio.lima at ufms.br
Sat Oct 1 04:12:07 CEST 2011


  
Dear GAPW users 
GAPW after the installation to run the test with
the command. 

gpaw-python `which gpaw-test` 2>&1 | tee
test.log

presented the following errors in the output files
(attached)

I am using Ubuntu 11, i7 processor on core, 32bit,
gfortran

The library has installed the ASE test. Jacapo compile
gfortran codes by the DaCapo

Where installed the latest versions 

It
was installed the following libraries and their paths 

- netcdf-4.0.1 

 ./configure --prefix=/usr/local/netcdf-4.0.1 FC=gfortran FCFLAGS=-O2
CC=gcc CXX=c++ CPPFLAGS='-DNDEBUG -DpgiFortran -fPIC'  
make check 

sudo make install  
- fftw-2.1.5  
 ./configure
--prefix=/usr/local/fftw-2.1.5 F77=gfortran CC=gcc CFLAGS=-O3 FFLAGS=-O3
--enable-shared --enable-threads  
make  
sudo make install  
-
openmpi-1.4.1  
 ./configure --prefix=/usr/local/openmpi-1.4.1
FC=gfortran F77=gfortran CC=gcc CXX=g++ FFLAGS=-O2 FCFLAGS=-O2
CFLAGS=-O2 CXXFLAGS=-O2  
make  
sudo make install Really do not know
what mistake I did. 

Best Regardes  
Fábio de Lima 

--  

Fábio de
Lima
Chemistry Department - UFMS
Phone: 55 (67) 3345-3596
Cellular: 55
(67) 9639-1338
  
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