quantum-espresso

Author	SHA1	Message	Date
cavazzon	962296d977	deallocation statements added to CPV for neb like dynamics git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@601 c92efa57-630b-4861-b058-cf58834340f0	2004-02-16 09:53:00 +00:00
giannozz	5c6bba2639	Workaround in PW/h_psi.f90 for ifc v.8 (works, only pwcond doesn't) Manual updated, example6/run_example modified to prevent SP4 weirdness Empty workspace module removed. Misc cleanup. git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@538 c92efa57-630b-4861-b058-cf58834340f0	2004-01-28 18:14:17 +00:00
giannozz	0b1a5c9fd8	Extensive module cleanup: DP moved from wrong place (parameters) to the correct place (kinds); module "varie" replaced by "control_flags" (not yet in pwcom, though) - many many files changed. 64-bit cpus (Opteron, maybe Itanium) should now work if __LINUX64 is defined git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@513 c92efa57-630b-4861-b058-cf58834340f0	2004-01-23 15:08:03 +00:00
cavazzon	c5d8ff2f66	- unit 6 replaced by stdout in CPV - ^M removed from pseudo files - wavefunctions arrais moved to module wavefunctions_module, common to all codes this is required to reduce duplicated subroutine - new lapack subroutine, called from PWCOND, added to lib/lapack.f lib/lapack_ibm.f git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@381 c92efa57-630b-4861-b058-cf58834340f0	2003-11-09 10:42:50 +00:00