cp2k_shell: Add commands GET_CELL, SET_CELL, and GET_STRESS

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14220 bac0169d-1eea-4375-b5f6-f89d2ced9994
fix comment headers

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14221 bac0169d-1eea-4375-b5f6-f89d2ced9994
XC_FUNCTIONAL: Add alias LDA -> PADE

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14222 bac0169d-1eea-4375-b5f6-f89d2ced9994
Fix too long line

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14223 bac0169d-1eea-4375-b5f6-f89d2ced9994
cp2k_shell: Add EXIT command

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14224 bac0169d-1eea-4375-b5f6-f89d2ced9994
rtp: reduce numerical noise

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14225 bac0169d-1eea-4375-b5f6-f89d2ced9994
cp2k_shell: Allow redirection of output

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14226 bac0169d-1eea-4375-b5f6-f89d2ced9994
f77_interface: Fix units of get_stress_tensor

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14227 bac0169d-1eea-4375-b5f6-f89d2ced9994
rtp: make accuracy refinement an imput parameter

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14228 bac0169d-1eea-4375-b5f6-f89d2ced9994
fix Doxygen errors (Vedran Miletić)


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14229 bac0169d-1eea-4375-b5f6-f89d2ced9994
more doxygen fixes (Vedran Miletić)


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14230 bac0169d-1eea-4375-b5f6-f89d2ced9994
doxify


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14231 bac0169d-1eea-4375-b5f6-f89d2ced9994
fix to doxify format


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14232 bac0169d-1eea-4375-b5f6-f89d2ced9994
Only touch the original file if doxify actually made a change


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14233 bac0169d-1eea-4375-b5f6-f89d2ced9994
Input Description Change (Vedran Miletić)

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14234 bac0169d-1eea-4375-b5f6-f89d2ced9994
Remove all OpenMP threadprivate variables

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14235 bac0169d-1eea-4375-b5f6-f89d2ced9994
fix data race, explicitly use default(none)


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14236 bac0169d-1eea-4375-b5f6-f89d2ced9994
more tol


git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14237 bac0169d-1eea-4375-b5f6-f89d2ced9994
Fix deadlock in d3_poly.F

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14238 bac0169d-1eea-4375-b5f6-f89d2ced9994
Input Description Change

git-svn-id: svn://svn.code.sf.net/p/cp2k/code/trunk@14239 bac0169d-1eea-4375-b5f6-f89d2ced9994