5 Commits

Author	SHA1	Message	Date
giannozz	3a98e2d9d4	More patches from Axel: ... - correct an unquoted string (iosys) in PW/input.f90:483 (this was the cause of tonight compilation failere) - correct a few incorrect format strings - make more use of the constants module and thus provide more consistent units. NOTE, this has some numerical changes in the outputs, as in some places rather low precision and inconsistent numbers were used for unit conversion. - convert all(?) single precision constants to double using the attached little perl program. exceptions: efermi.f90 (as it is supposed to be rewritten anyways), plotbands.f90 (it uses single precision everywhere, which may result in saving a significant amount of memory, so i converted the two double precision constants to single). Unused routine 'set_fft_grid' removed git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3602 c92efa57-630b-4861-b058-cf58834340f0	2006-12-14 08:53:47 +00:00
giannozz	cc73a76a46	- misspell in configure ... - symmetrize_at needed for compilation of PP - more preprocessing cleanup git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3427 c92efa57-630b-4861-b058-cf58834340f0	2006-10-03 14:29:27 +00:00
giannozz	0d6fa99b88	Added check on the presence of a slash at the end of outdir everywhere. ... Since it is done in 100 places, I added a small function 'trimcheck' git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2749 c92efa57-630b-4861-b058-cf58834340f0	2006-01-31 17:22:28 +00:00
giannozz	7fb0f488da	Bug fix for spin-polarized case (Andrea Ferretti) ... git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2490 c92efa57-630b-4861-b058-cf58834340f0	2005-11-18 14:02:25 +00:00
giannozz	afcb40bc62	Minor change + auxilary code ot sum PDOS by Andrea Ferretti ... git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2448 c92efa57-630b-4861-b058-cf58834340f0	2005-11-09 17:06:21 +00:00