[Pw_forum] Can I get pw.x and memory.x for my linux pc cluster

Axel Kohlmeyer axel.kohlmeyer at theochem.ruhr-uni-bochum.de
Sat Feb 12 21:19:36 CET 2005


On Sat, 12 Feb 2005, Abdelouahab O. wrote:

AO> 
AO> Thanks;
AO> 
AO> I've changed the make.sys like you's

[...]

AO> 
AO> LD = mpiifort -i-static
AO> 
AO> LDFLAGS = -static-libcxa $(LIBOBJS)

you should use either of '-i-static' or '-static-libcxa' 
but not both. which one depends on your compiler version.
if you have the update from the support site, you should
use '-i-static', for the (older) download version, you should
use '-static-libcxa'.

[...]

AO> 
AO> LIBS = -L/home/wahab/atals -latlas_p4 -L/opt/intel/mkl72/lib/32 -lmkl_lapack -lmkl_ia32 -lguide -L/usr/lib/lam
AO> 
[...]

AO> 
AO> but the line: LIBS = -L/home/wahab/atals -latlas_p4
AO> -L/opt/intel/mkl72/lib/32 -lmkl_lapack -lmkl_ia32
AO> 
AO> because i think the library in your "/home/akohlmey/lib" is atlas
AO> libs; so I added the atlas library with the mkl

as far as PWscf is concerned, ATLAS and MKL provide the same 
functionality, so you need only one of them. 

AO> ../Modules/uspp.o ../Modules/version.o ../Modules/wavefunctions.o -static-libcxa ../flib/ptools.a ../flib/flib.a ../clib/clib.a
AO> 
AO> ld: cannot find -lirc_s

libirc_s.a is distributed with both icc and ifort, so there may
be an installation problem. i have no problem at all.

in fact, today i found some time to compile 'clean' serial and
lam-7.0.6 versions for pentium 4, athlon (xp), and opteron.
you can find the binaries in a few hours at:
http://ftp.theochem.ruhr-uni-bochum.de/outgoing/axel_kohlmeyer/pwscf-bin/

regards,
	axel kohlmeyer.

[...]


-- 
=======================================================================
Dr. Axel Kohlmeyer   e-mail: axel.kohlmeyer at theochem.ruhr-uni-bochum.de
Lehrstuhl fuer Theoretische Chemie          Phone: ++49 (0)234/32-26673
Ruhr-Universitaet Bochum - NC 03/53         Fax:   ++49 (0)234/32-14045
D-44780 Bochum  http://www.theochem.ruhr-uni-bochum.de/~axel.kohlmeyer/
=======================================================================
If you make something idiot-proof, the universe creates a better idiot.




More information about the users mailing list