fix gfortran 4.4 compatibility

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13843 bac0169d-1eea-4375-b5f6-f89d2ced9994
rtp:Bugfix of the rtp/bch/etrs combination

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13844 bac0169d-1eea-4375-b5f6-f89d2ced9994
Small clean up.


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13845 bac0169d-1eea-4375-b5f6-f89d2ced9994
rtp:some clean-up

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13846 bac0169d-1eea-4375-b5f6-f89d2ced9994
Do not set mkl_dft_number_of_user_threads for MKL > 11.1.0, as it is now thread-safe by default


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13847 bac0169d-1eea-4375-b5f6-f89d2ced9994
Speed up calculation of 3-center integrals (LRIGPW)

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13848 bac0169d-1eea-4375-b5f6-f89d2ced9994
use the integer math


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13849 bac0169d-1eea-4375-b5f6-f89d2ced9994
remove unused function


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13850 bac0169d-1eea-4375-b5f6-f89d2ced9994
add a few more libtests for dbcsr


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13851 bac0169d-1eea-4375-b5f6-f89d2ced9994
rtp: fixing some values beeing single precision

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13852 bac0169d-1eea-4375-b5f6-f89d2ced9994
rtp: cleanup

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13853 bac0169d-1eea-4375-b5f6-f89d2ced9994
remove empty unused subroutine


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13854 bac0169d-1eea-4375-b5f6-f89d2ced9994
don't make an unused subroutine public


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13855 bac0169d-1eea-4375-b5f6-f89d2ced9994
debug regtest


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13856 bac0169d-1eea-4375-b5f6-f89d2ced9994
one more timeset


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13857 bac0169d-1eea-4375-b5f6-f89d2ced9994
add a base and mpiwrap package


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13858 bac0169d-1eea-4375-b5f6-f89d2ced9994
add package


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13859 bac0169d-1eea-4375-b5f6-f89d2ced9994
g95 bug workaround ?


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13860 bac0169d-1eea-4375-b5f6-f89d2ced9994
prettify


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13861 bac0169d-1eea-4375-b5f6-f89d2ced9994
second g95 bug workaround attempt


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@13862 bac0169d-1eea-4375-b5f6-f89d2ced9994