Dear wien2k users,
Our problem is solved. There is an error of
"space" in R_LIBS option.
Thanks for your responses.
with regards,
On Thu, Feb 13, 2014 at 12:12 PM, shamik chakrabarti wrote:
> Dear wien2k users,
>
>Thanks for your response. But still we have not ab
Dear wien2k users,
Thanks for your response. But still we have not able to solve the
problem.We are using recent version of compiler consists of both fortran
and mkl library: Composer_xe_2013_Sp1.1.106. We are using Red-Hat linux. We
are installing wien2k 13 and have set the following options:
If I search the net, I can find a linux library "-lpthread" and a mkl
thread library "-lmkl_intel_thread".
However, I cannot find a mkl thread library called "lmkl_lpthread.so" or
"-lmkl_lpthread". These libraries might not exist.
On 2/12/2014 3:40 PM, Peter Blaha wrote:
The message looks to
The message looks to me as if you have missed the "-" sign in front of the
-lmkl_lpthread statement in your linker or R_LIB line.
We are trying to install wien2k version 13 in our system. During
compilation we are getting stuck due to an error message:
*ld: can not able to find lmkl_
Excellent description, but I would suggest replacing ifortvars.sh (for
only ifort) with compilervars.sh (for ifort+mkl).
The standard method is to (before compilation) do
source COMPOSER_PATH/bin/ifortvars.sh CPUTYPE
where COMPOSER_PATH is where you put the compiler, and CPUTYPE is
either int
The change of TOT to FOR is controlled by the -fc option. The meaning
of -I is that FOR is switched back to TOT at the start of a new scf
cycle. If -fc is present, than it will switch to FOR again for the
last iteration of that scf cycle.
Stefaan
==
I was wondering why "TOT" would switch to "FOR" in case.in2-files
despite using "-I" flag?
The change of TOT to FOR is controlled by the -fc option. The meaning of
-I is that FOR is switched back to TOT at the start of a new scf cycle.
If -fc is present, than it will switch to FOR again for
The standard method is to (before compilation) do
source COMPOSER_PATH/bin/ifortvars.sh CPUTYPE
where COMPOSER_PATH is where you put the compiler, and CPUTYPE is
either intel64 or ia32
For COMPOSER_PATH you can use the generic such as /opt/intel/composer
(which links to the latest version instal
try with these options. it may work.
current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -O1 -traceback
current:LDFLAGS:$(FOPT)
-L/opt/intel/composerxe-2011.3.174/compiler/lib/intel64 -shared-intel
-lsvml -openmp -lpthread
current:DPARALLEL:'-DParallel'
current:R_LIBS:-L/opt/intel/composerxe-20
Dear Wien2k user,
I was wondering why "TOT" would switch to "FOR" in case.in2-files
despite using "-I" flag?
Cheers,
Salman
__
Dear Wien2k users,
We are trying to install wien2k version 13 in our system. During
compilation we are getting stuck due to an error message:
*ld: can not able to find lmkl_lpthread.so*
we have taken the following measure but get no success so far:
(1) checked the correctness of mkl librar
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