[CPMD-list] Compilation Problems

Rad radbalu at comcast.net
Wed Dec 14 11:56:24 CET 2005


Dear All,

 

I am having some difficulties in the compilation of version 3.9.2 on Linux
Cluster running RH edition ( I was able to compile the same code on a
different cluster using LAM and MPICH for 32 as well as 64 bit
architectures). When I tried to compile the code using an mpich
configuration where the mpif77 wrapper uses ifort compiler, I get the error
shown in the attachment. Here is the portion of the makefile I used:

 

SRC  = .

DEST = .

BIN  = .

#QMMM_FLAGS = -D__QMECHCOUPL

#QMMM_LIBS  = -L. -lmm

MYFFLAGS =  $(CPPFLAGS)

#IPAFLAGS =  

FFLAGS = -c -w90 -w95 -O2 -unroll -pc64 -tpp7 -cm $(CPPFLAGS)

#LFLAGS = -llapack-ifc -lblas-ifc -latlas-ifc -Vaxlib $(QMMM_LIBS)

#LFLAGS =   -L/opt/intel/lib/  -lmkl_itp -lmkl_lapack -lmkl_itp \

#             -lPEPCF90 -lm -lguide -lpthread $(QMMM_LIBS)

LFLAGS = -L. -latlas_p4

CFLAGS = -D__alpha

CPP = /lib/cpp -P -C -traditional

CPPFLAGS = -D__alpha -DPOINTER8 -DLAPACK -DFFT_DEFAULT -DALPHALINUX \

        -DMYRINET -DPARALLEL=parallel -DMP_LIBRARY=__MPI   

NOOPT_FLAG = 

CC = -I/opt/mpich-1.2.5.9-ch_gm-gcc/bin/mpicc

#FC = /usr/local/mpich-1.2.5.2/bin/mpif90

#LD = /usr/local/mpich-1.2.5.2/bin/mpif90

#FC = mpif77 -I/opt/mpich-1.2.5.9-ch_gm-gcc/bin

FC = /opt/intel/bin/ifort

FC = mpif77

LD = /opt/intel/bin/ifort

LD = mpif77

AR =

 

I would appreciate any suggestion the group may offer in resolving this
issue and also please let me know if more information is needed about the
environmet.

 

 

Thanks

Rad Balu

 

 

-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://cpmd.org/pipermail/cpmd-list/attachments/20051214/98f708e4/attachment.html 
-------------- next part --------------
An embedded and charset-unspecified text was scrubbed...
Name: cpmd-errors.txt
Url: http://cpmd.org/pipermail/cpmd-list/attachments/20051214/98f708e4/attachment.txt 


More information about the CPMD-list mailing list