3773af5b7d
- bug fix: charge density incorrectly read in lsda case
...
- io_pot removed, replaced by read_rho, write_rho. It looks like it is
working but more testing is needed
- Makeifles updated
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3072 c92efa57-630b-4861-b058-cf58834340f0
2006-05-03 21:08:23 +00:00
533fd082f5
Small change to compile vib.
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3026 c92efa57-630b-4861-b058-cf58834340f0
2006-04-18 14:41:23 +00:00
3733ffdb94
Old file format and related files deleted, makefiles updated accordingly
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2949 c92efa57-630b-4861-b058-cf58834340f0
2006-03-23 11:00:52 +00:00
2272afad1b
Makefile updated
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2936 c92efa57-630b-4861-b058-cf58834340f0
2006-03-22 16:39:14 +00:00
5e135c2fc6
Makefile update
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2895 c92efa57-630b-4861-b058-cf58834340f0
2006-03-09 13:18:15 +00:00
d39f6c87b2
- fixed a conflict between variable and module names.
...
- remuved a reference to cft_3.o
- WARNING makefile.pwvib is overriding `.f90.o' rule!
thus VIB do not compile with PGI and XLF
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2841 c92efa57-630b-4861-b058-cf58834340f0
2006-02-21 09:19:16 +00:00
c71243d743
- Makefile updated
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2840 c92efa57-630b-4861-b058-cf58834340f0
2006-02-20 09:42:59 +00:00
e18827f831
Makefile updated
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2825 c92efa57-630b-4861-b058-cf58834340f0
2006-02-15 17:44:09 +00:00
2670c0d1a4
symbolic link in /bin directory is now properly created. [silviu]
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2787 c92efa57-630b-4861-b058-cf58834340f0
2006-02-08 10:45:53 +00:00
2a5e714853
makefiles modified to avoid the operation 'FFLAGS += ...' which IBM machines seem to dislike. [silviu]
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2786 c92efa57-630b-4861-b058-cf58834340f0
2006-02-08 09:54:38 +00:00
f60d44607c
fixed dependencies. [silviu]
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2785 c92efa57-630b-4861-b058-cf58834340f0
2006-02-08 09:36:22 +00:00
99660c8920
Added missing dependency (rdiagh)
...
Why are there copies of rdiagh.f90 and rdiaghg.f90 in VIB/ ???
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2784 c92efa57-630b-4861-b058-cf58834340f0
2006-02-08 08:19:38 +00:00
afc0e2f5e2
Makefile updated to reflect recent changes (dynamics.o => dynamics_module.o)
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2719 c92efa57-630b-4861-b058-cf58834340f0
2006-01-23 11:45:28 +00:00
1d3dfe4cb1
Directory name change CPVIB-->VIB (Courtesy of Paolo Gianozzi). Please
...
remove directory CPVIB, run: "cvs update -d" and makedeps.sh before
recompiling. [silviu]
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2671 c92efa57-630b-4861-b058-cf58834340f0
2005-12-29 22:57:50 +00:00
4e30453fa1
some steps towards getting Born charges and IR intensities with pwvib.
...
Subroutine poles is moved from CPV/cplib.f90 (not used in cp.x) to cpvib/pwvib.
[silviu]
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2665 c92efa57-630b-4861-b058-cf58834340f0
2005-12-29 08:38:27 +00:00
20cf4a53fc
adaptations to makefiles [silviu]
...
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2610 c92efa57-630b-4861-b058-cf58834340f0
2005-12-19 13:37:08 +00:00
giannozz