libint-2.2.2 error when building CP2K 5.1 with Intel Composer 2017 update5
Jerry Tanoury
jerryt... at gmail.com
Tue Feb 27 18:46:25 UTC 2018
Hi,
I am trying to build CP2K 5.1 with Intel compilers and MKL libs. I am
using ComposerXE 2017 update 5 (2017.5.239) with associated MKL libs, and
MPI library parallel studio 2017.5.061. My arch file is attached. At the
end of the build I get the following error:
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
ld: ld: Warning: size of symbol `build_deriv1_eri' changed from 5000 in
/cluster/home/tanoury/CP2K/cp2k-5.1/lib/CP2K_allintel/popt/libcp2kmain.a(hfx_libint_wrapper.o)
to 10368 in
/cluster/home/tanoury/CP2K/intelbuilt_packages/2017u5/libint-1.1.4/lib/libderiv.a(init_libderiv.o)Warning:
size of symbol `build_deriv1_eri' changed from 5000 in
/cluster/home/tanoury/CP2K/cp2k-5.1/lib/CP2K_allintel/popt/libcp2kmain.a(hfx_libint_wrapper.o)
to 10368 in
/cluster/home/tanoury/CP2K/intelbuilt_packages/2017u5/libint-1.1.4/lib/libderiv.a(init_libderiv.o)
ld: Warning: size of symbol `build_deriv1_eri' changed from 5000 in
/cluster/home/tanoury/CP2K/cp2k-5.1/lib/CP2K_allintel/popt/libcp2kmain.a(hfx_libint_wrapper.o)
to 10368 in
/cluster/home/tanoury/CP2K/intelbuilt_packages/2017u5/libint-1.1.4/lib/libderiv.a(init_libderiv.o)
ld: ld: Warning: size of symbol `build_eri' changed from 10368 in
/cluster/home/tanoury/CP2K/cp2k-5.1/lib/CP2K_allintel/popt/libcp2kmain.a(hfx_libint_wrapper.o)
to 19208 in
/cluster/home/tanoury/CP2K/intelbuilt_packages/2017u5/libint-1.1.4/lib/libint.a(init_libint.o)Warning:
size of symbol `build_eri' changed from 10368 in
/cluster/home/tanoury/CP2K/cp2k-5.1/lib/CP2K_allintel/popt/libcp2kmain.a(hfx_libint_wrapper.o)
to 19208 in
/cluster/home/tanoury/CP2K/intelbuilt_packages/2017u5/libint-1.1.4/lib/libint.a(init_libint.o)
ld: Warning: size of symbol `build_eri' changed from 10368 in
/cluster/home/tanoury/CP2K/cp2k-5.1/lib/CP2K_allintel/popt/libcp2kmain.a(hfx_libint_wrapper.o)
to 19208 in
/cluster/home/tanoury/CP2K/intelbuilt_packages/2017u5/libint-1.1.4/lib/libint.a(init_libint.o)
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
My build of libint-2.2.2 is: ../configure
--prefix=/cluster/home/tanoury/CP2K/intelbuilt_packages/2017u5/libint-1.1.4
--with-libint-max-am=6 --with-libderiv-max-am1=5 --with-cc="icc -O2 -xHost"
--with-cc-optflags="-O2 -xHost" --with-cxx="icpc -O2 -xHost"
--with-cxx-optflags="-O2 -xHost"
I've read previous threads about matching the am and am1 values between the
CP2K build and the libint build, which I have done. I'm not sure what's
going on here.
Thank you for the help,
Jerry
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