26648245ab
me_image replace with ionode in weights. eliminatinted obsolete me_image
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in rotate_wfc and cegterg
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7641 c92efa57-630b-4861-b058-cf58834340f0
2011-03-30 10:23:57 +00:00
6620745773
Subroutine re-written in a less clumsy way; potential out-of-bound error in the
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non-colinear, fixed-occupancies case (which likely doesn't work anyway).
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7552 c92efa57-630b-4861-b058-cf58834340f0
2011-03-07 11:02:48 +00:00
161d0a518d
Fermi energy always initialized to something
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git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6605 c92efa57-630b-4861-b058-cf58834340f0
2010-04-08 16:31:28 +00:00
3cd50d0257
More cleanup: spelling of Quantum ESPRESSO, CMPLX explicitly cast, f_defs.h
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removed, a few REAL transformed into DBLE. Note that my previos statement
about REAL is overblown: REAl(C) is perfectly safe if C is a double precision
complex number. All changes should be safe.
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5793 c92efa57-630b-4861-b058-cf58834340f0
2009-08-01 17:48:59 +00:00
a2b5ab5e50
Minor partial cleanup. Many routines declared unused variables. Many others
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could be cleaned.
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5445 c92efa57-630b-4861-b058-cf58834340f0
2009-02-25 15:58:53 +00:00
259fe1b6e7
- celanup, poolreduce replaced by mp_sum(...,inter_pool_comm)
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git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4643 c92efa57-630b-4861-b058-cf58834340f0
2008-01-23 16:53:17 +00:00
466c5581ee
Oops, this was missing
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git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3722 c92efa57-630b-4861-b058-cf58834340f0
2007-01-29 11:36:33 +00:00
marsamos