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12 Commits

Author SHA1 Message Date
dalcorso ffc76c84c0 Small cleanup. add_vuspsi does not use psi. 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6002 c92efa57-630b-4861-b058-cf58834340f0
 2009-10-14 14:32:37 +00:00
degironc fb6d84f554 In an attempt to unifying the management of becp-like variables in various cases 
(gamma_only, noncolin and generic k) a derived data-type bec_type is introduced
in becmod with component %r (for gamma real case), %nc (for non colinear case)
and %k (for the generic k case) .
The changes were tivial (rbecp -> becp%r, becp->becp%k, becp_nc->becp%nc) but
pervasive... I tried my best to test that everything is ok

stefano


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5937 c92efa57-630b-4861-b058-cf58834340f0
 2009-09-16 15:26:25 +00:00
giannozz 5975a0d477 More of the same 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5803 c92efa57-630b-4861-b058-cf58834340f0
 2009-08-03 08:15:09 +00:00
giannozz be76efc343 More cleanup (?): modules "uspp" and "symme" extracted from "pwcom" 
everywhere. I didn't like the previous half-baked state.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5128 c92efa57-630b-4861-b058-cf58834340f0
 2008-08-23 17:55:06 +00:00
seitsonen 2d04540126 Changed the format of output, USE-ONLY's up-dated, interpolation-by-splines 
introduced, ...

       apsi


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4753 c92efa57-630b-4861-b058-cf58834340f0
 2008-03-22 14:10:41 +00:00
giannozz efa75a8d99 More "calbec" cleanup - PLEASE TEST 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4531 c92efa57-630b-4861-b058-cf58834340f0
 2007-12-18 21:29:10 +00:00
ceresoli a8af1cde73 <beta|psi> cleanup. (D.C.) 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4510 c92efa57-630b-4861-b058-cf58834340f0
 2007-12-06 10:57:44 +00:00
ceresoli 50d7de6418 Trying to stay up-to-date with the recent CVS changes. Gipaw compiles 
cleanly but doesn't not working at all!
I give up: I'm going in vacation for the next few days. (D.C.)


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3814 c92efa57-630b-4861-b058-cf58834340f0
 2007-02-23 15:32:08 +00:00
giannozz 6357befd22 Axel's patch for single-precision constants (please do not add more!) 
GIPAW/make.depend added to CVS, like all others - should be updated
when dependencies change using "./makedeps.sh GIPAW" from the root
directory of QE


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3724 c92efa57-630b-4861-b058-cf58834340f0
 2007-01-30 10:38:10 +00:00
seitsonen 189811559c Removed obsolete code (with license to delete by Davide Ceresoli) 
apsi


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3670 c92efa57-630b-4861-b058-cf58834340f0
 2007-01-15 15:59:29 +00:00
seitsonen 180f6aea6b - changed all 'nmr_*' and 'magn_*' into 'gipaw_*' for all references to the 
main code
 - 'compute_sigma.f90' containts all the three components of the sigma
     tensor, thus the filename was changed

       apsi


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3663 c92efa57-630b-4861-b058-cf58834340f0
 2007-01-15 11:45:23 +00:00
seitsonen f926db4ce1 Initial release (previously developed against tag QE-3-1-1 in directory 
NMR_new).


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3662 c92efa57-630b-4861-b058-cf58834340f0
 2007-01-15 11:29:24 +00:00