DBCSR: Create module dbcsr_mp_methods

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14514 bac0169d-1eea-4375-b5f6-f89d2ced9994
DFTB/QMMM: Full periodic coupling, new regtest


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14515 bac0169d-1eea-4375-b5f6-f89d2ced9994
DBCSR: Create module dbcsr_dist_methods

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14516 bac0169d-1eea-4375-b5f6-f89d2ced9994
Add DFTB/QMMM regtest file


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14517 bac0169d-1eea-4375-b5f6-f89d2ced9994
prettify

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14518 bac0169d-1eea-4375-b5f6-f89d2ced9994
Move high-level routines from dbcsr_methods into dbcsr_operations

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14519 bac0169d-1eea-4375-b5f6-f89d2ced9994
Move init/release routines into dbcsr_methods

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14520 bac0169d-1eea-4375-b5f6-f89d2ced9994
Move dbcsr_switch_data_area() into dbcsr_data_methods

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14521 bac0169d-1eea-4375-b5f6-f89d2ced9994
DBCSR: Remove unnecessary INTERFACEs

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14522 bac0169d-1eea-4375-b5f6-f89d2ced9994
DBCSR: Replace dbcsr_get_data_size_referenced() with dbcsr_data_get_size_referenced()

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14523 bac0169d-1eea-4375-b5f6-f89d2ced9994
arnoldi method for eigenvalue and eigenvector computation of sparse matrices (s/d/z/c)

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14524 bac0169d-1eea-4375-b5f6-f89d2ced9994
prettify

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14525 bac0169d-1eea-4375-b5f6-f89d2ced9994
DBCSR: Improve dbcsr_multiply_api.F

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14526 bac0169d-1eea-4375-b5f6-f89d2ced9994
prettify

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14527 bac0169d-1eea-4375-b5f6-f89d2ced9994
DBCSR: Create module dbcsr_data_types

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14528 bac0169d-1eea-4375-b5f6-f89d2ced9994
rtp: add dipole calculation to linear scaling part

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14529 bac0169d-1eea-4375-b5f6-f89d2ced9994
DFTB/QMMM small bug fix and new coordinates for test examples


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14530 bac0169d-1eea-4375-b5f6-f89d2ced9994
add library test for arnoldi and timings for the code

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14531 bac0169d-1eea-4375-b5f6-f89d2ced9994
Create package dbcsr/error

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Create package dbcsr/data

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