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139 Commits

Author SHA1 Message Date
kokalj eee241ba3d updating help file 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@9644 c92efa57-630b-4861-b058-cf58834340f0
 2012-11-22 12:46:49 +00:00
kokalj ee0587de17 adding a few new input variables 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@9643 c92efa57-630b-4861-b058-cf58834340f0
 2012-11-22 12:46:34 +00:00
kokalj 8340769cc3 adding a few new input variables 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@9642 c92efa57-630b-4861-b058-cf58834340f0
 2012-11-22 12:45:29 +00:00
kokalj a5825065a7 * adopting to new CELL_PARAMETERS options alat|bohr|angstroms 
* several stylistic improvements


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8994 c92efa57-630b-4861-b058-cf58834340f0
 2012-05-14 10:40:59 +00:00
kokalj 930c9af388 cleanup 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8990 c92efa57-630b-4861-b058-cf58834340f0
 2012-05-13 21:10:47 +00:00
kokalj b1b5e48163 updating help for PWgui's module dos.x 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8988 c92efa57-630b-4861-b058-cf58834340f0
 2012-05-13 21:06:28 +00:00
kokalj 9b2cef8afd updating PWgui's module pp.x (ibrav=9, reduced density gradient) 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8987 c92efa57-630b-4861-b058-cf58834340f0
 2012-05-13 21:05:47 +00:00
kokalj 4e1265c81b updating PWgui's module atomic 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8986 c92efa57-630b-4861-b058-cf58834340f0
 2012-05-13 21:04:36 +00:00
kokalj 43860fe056 updating PWgui's module ph.x (mainly dvscf_star & drho_star structures) 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8985 c92efa57-630b-4861-b058-cf58834340f0
 2012-05-13 21:04:01 +00:00
kokalj 98148144b7 updating PWgui's module pw.x (mainly EXX variables) 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8984 c92efa57-630b-4861-b058-cf58834340f0
 2012-05-13 21:02:17 +00:00
kokalj d27da279cb adding support for ibrav=-5 and -12 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8574 c92efa57-630b-4861-b058-cf58834340f0
 2012-02-03 07:41:32 +00:00
kokalj f0f92be0bc cleanup 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8531 c92efa57-630b-4861-b058-cf58834340f0
 2012-01-23 11:15:15 +00:00
kokalj 846c7fd084 cleanup 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8530 c92efa57-630b-4861-b058-cf58834340f0
 2012-01-23 11:14:42 +00:00
kokalj 523ef2f721 adding bands.x and dos.x modules to pwgui 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8525 c92efa57-630b-4861-b058-cf58834340f0
 2012-01-23 11:09:45 +00:00
kokalj 19da0e969a updating ld1.x's gui 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8509 c92efa57-630b-4861-b058-cf58834340f0
 2012-01-20 13:13:55 +00:00
kokalj 01bce5f684 updating projwfc.x's gui 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8507 c92efa57-630b-4861-b058-cf58834340f0
 2012-01-20 13:12:55 +00:00
kokalj 4a1e69c402 updating ph.x's gui 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8506 c92efa57-630b-4861-b058-cf58834340f0
 2012-01-20 13:12:20 +00:00
kokalj fbcc651a6f updating pw.x's gui 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8505 c92efa57-630b-4861-b058-cf58834340f0
 2012-01-20 13:11:48 +00:00
kokalj 84cc86404b updating pp.x module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7665 c92efa57-630b-4861-b058-cf58834340f0
 2011-04-06 10:26:29 +00:00
kokalj e214b44323 updating ph.x module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7664 c92efa57-630b-4861-b058-cf58834340f0
 2011-04-06 10:26:10 +00:00
kokalj e9fd82cb16 updating ld1.x module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7663 c92efa57-630b-4861-b058-cf58834340f0
 2011-04-06 10:24:46 +00:00
kokalj 18a7227064 updating pw.x module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7662 c92efa57-630b-4861-b058-cf58834340f0
 2011-04-06 10:24:25 +00:00
kokalj a66a3dd9e3 adding a neb.dat module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7661 c92efa57-630b-4861-b058-cf58834340f0
 2011-04-06 10:24:06 +00:00
kokalj c415753d52 updating help file according to recent INPUT_**.def changes 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6723 c92efa57-630b-4861-b058-cf58834340f0
 2010-05-04 16:03:13 +00:00
kokalj 98bc49c432 ld1.x (atomic) PWgui module updated 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6717 c92efa57-630b-4861-b058-cf58834340f0
 2010-05-04 12:38:27 +00:00
kokalj 88dcc1f338 ph.x PWgui module updated 
(obsolete variables deleted new variables added)


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6716 c92efa57-630b-4861-b058-cf58834340f0
 2010-05-04 11:51:56 +00:00
kokalj dbe0899da9 adding options plot_num = 17,18 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6715 c92efa57-630b-4861-b058-cf58834340f0
 2010-05-04 11:34:22 +00:00
kokalj cef56efac8 updating pp.x PWgui module 
(removing the z and dz remnants of stm_wfc_mathing)


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6714 c92efa57-630b-4861-b058-cf58834340f0
 2010-05-04 11:19:25 +00:00
kokalj 1c71f8cebe pw.x module of PWgui updated 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6712 c92efa57-630b-4861-b058-cf58834340f0
 2010-05-04 11:02:34 +00:00
giannozz 6c6031ffde PWGUI: obsolete variables removed 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6674 c92efa57-630b-4861-b058-cf58834340f0
 2010-04-28 12:39:20 +00:00
giannozz d50cfb94d1 PWGUI: Added a few new input variables, removed several obsolete ones 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6673 c92efa57-630b-4861-b058-cf58834340f0
 2010-04-28 12:14:15 +00:00
giannozz 1bd3370701 Namelist &phonon and related variables removed from PWscf. It wasn't working 
any longer since a long time. Documentation and GUI updated (no warranty the
latter works). Further cleanup of nelec, neldw, nelup in the documentation


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5968 c92efa57-630b-4861-b058-cf58834340f0
 2009-09-24 19:44:04 +00:00
kokalj f8b3e58785 the following tabs were renamed: 
"Lattice & Atomic data" --> "Lattice & Atoms"
"K-point data" --> "K-points"


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5820 c92efa57-630b-4861-b058-cf58834340f0
 2009-08-05 10:42:31 +00:00
kokalj 630ec448e1 small update 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5704 c92efa57-630b-4861-b058-cf58834340f0
 2009-07-17 07:13:43 +00:00
kokalj 210542dda0 adopting to plot_num = 9, which is no longer in use 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5703 c92efa57-630b-4861-b058-cf58834340f0
 2009-07-17 07:13:10 +00:00
kokalj 02fd42f91c oops 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5702 c92efa57-630b-4861-b058-cf58834340f0
 2009-07-16 17:00:45 +00:00
kokalj a379c0fe05 corresting possible values for CI_scheme 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5699 c92efa57-630b-4861-b058-cf58834340f0
 2009-07-16 16:55:56 +00:00
kokalj b8ddb59ab7 updating pw.x module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5698 c92efa57-630b-4861-b058-cf58834340f0
 2009-07-16 15:05:26 +00:00
kokalj f980ca647d updating pwgui's atomic module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5312 c92efa57-630b-4861-b058-cf58834340f0
 2008-12-02 12:01:35 +00:00
kokalj 22341ee0a2 updating pwgui's ph.x module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5311 c92efa57-630b-4861-b058-cf58834340f0
 2008-12-02 12:01:10 +00:00
kokalj dbb43e1437 updating pwgui's pw.x module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5310 c92efa57-630b-4861-b058-cf58834340f0
 2008-12-02 12:00:51 +00:00
kokalj aa7a419d2b fixing bug spotted by Lorenzo concerning the widgets state for various type of k-points input 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4958 c92efa57-630b-4861-b058-cf58834340f0
 2008-06-02 12:49:29 +00:00
kokalj cfe032fe26 updating/synchronizing atomic module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4893 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-08 18:58:26 +00:00
kokalj 349d6222de updating/synchronizing d3 module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4892 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-08 18:58:06 +00:00
kokalj deae4e21ac updating/synchronizing ph module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4891 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-08 18:57:48 +00:00
kokalj 7d5c91f599 updating/synchronizing pp module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4890 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-08 18:57:28 +00:00
kokalj ecd5377b8c updating/synchronizing projwfc module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4889 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-08 18:57:08 +00:00
kokalj 303a16f1ad updating/synchronizing pw module 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4888 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-08 18:56:36 +00:00
kokalj ab15c9263f adding lsave_wfc variable 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4865 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-05 15:03:02 +00:00
kokalj ebc1397740 typo correction 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4864 c92efa57-630b-4861-b058-cf58834340f0
 2008-05-05 14:49:46 +00:00
kokalj f2842c8070 Adding lsym variable. 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4728 c92efa57-630b-4861-b058-cf58834340f0
 2008-02-29 08:27:31 +00:00
kokalj a326f45f94 Synchronising(updating) PWgui with QE 4.0cvs. For changes see files: 
GUI/PWgui/ChangeLog and NEWS.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4701 c92efa57-630b-4861-b058-cf58834340f0
 2008-02-15 18:10:09 +00:00
kokalj 7fc13c151c Synchronising(updating) PWgui with QE 4.0cvs. For changes see files: 
GUI/PWgui/ChangeLog and NEWS.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4700 c92efa57-630b-4861-b058-cf58834340f0
 2008-02-15 17:51:32 +00:00
giannozz a8b6cbf0d0 GUI for atromic code dl1.x updated 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3138 c92efa57-630b-4861-b058-cf58834340f0
 2006-05-26 13:50:32 +00:00
kokalj f79f80406b synchronizing PWgui modules with QE-3.1 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3134 c92efa57-630b-4861-b058-cf58834340f0
 2006-05-23 16:52:24 +00:00
kokalj 4d97495037 the fe_step() dimension (for metadynamics) has not been linked 
with the auxil-variable n_fe_step


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2487 c92efa57-630b-4861-b058-cf58834340f0
 2005-11-18 07:00:40 +00:00
kokalj caabe8c403 updating CONSTRAINS card 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2479 c92efa57-630b-4861-b058-cf58834340f0
 2005-11-15 08:42:11 +00:00
kokalj 8fbd8ec3c2 updating the PWgui's PW module to refelct new input. 
In particular:

- the noncolinear and constrained/fixed magnetization staff has been added (please check)
- the support for 'metadyn' type calculation has been added
(please check)

Not yet DONE: the gui cannot handle (yet) the new form of CONSTRANITS card.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2456 c92efa57-630b-4861-b058-cf58834340f0
 2005-11-10 15:09:41 +00:00
kokalj 6f9bbaf7ea improving atomic_coordinates validators 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2232 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-26 11:56:16 +00:00
giannozz 34f3df5d19 Phonon GUI updated - some options still not implemented 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2209 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-23 08:57:47 +00:00
sbraccia e567949e11 GUI and documentation updated to reflect the new input. 
C.S.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2201 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-20 20:54:31 +00:00
giannozz 9fbc9e1930 Help completed for ld1 GUI 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2197 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-20 10:35:26 +00:00
giannozz 7eb89d94fb GUI updated to reflect new input of pp.x - chdens.x input removed, 
documentation (marginally) updated


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2179 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-14 17:24:01 +00:00
kokalj 3ec36f88cd Elaborating a bit on Paolo's coding. In particular, making pages and event handlers ... 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2173 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-13 13:54:46 +00:00
giannozz 780b00cedd First attempt, not yet completely working, of a GUI for the atomic code 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2166 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-12 17:13:52 +00:00
giannozz a5e875cfc9 GUI for chdens updated 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2084 c92efa57-630b-4861-b058-cf58834340f0
 2005-08-03 09:07:07 +00:00
degironc 85c6033751 the help section for eangle1 and angle2 has been added 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1752 c92efa57-630b-4861-b058-cf58834340f0
 2005-03-24 12:58:30 +00:00
degironc b6b65e70c4 my first elementary contibution to PWgui... 
nspin=4 in the non collinear case
starting_magnetization is dimesioned ntyp (not nat)
angle1 and angle2 can be defined in the non collinear case

SdG


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1751 c92efa57-630b-4861-b058-cf58834340f0
 2005-03-24 12:48:34 +00:00
kokalj 7555262b9c adding wf_collect variable 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1749 c92efa57-630b-4861-b058-cf58834340f0
 2005-03-24 07:03:41 +00:00
kokalj 11d04d79f0 pp.x module slightly updated to syntax of PWscf-2.1.2 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1738 c92efa57-630b-4861-b058-cf58834340f0
 2005-03-23 11:25:27 +00:00
kokalj b8b222e693 Updating module to syntax of PWscf-2.1.2 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1736 c92efa57-630b-4861-b058-cf58834340f0
 2005-03-23 09:52:42 +00:00
giannozz 5a8f290016 ttol => tolp : update documentation and GUI 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1570 c92efa57-630b-4861-b058-cf58834340f0
 2005-01-17 18:34:57 +00:00
kokalj 116e66e35a module updated to new projwfc.x syntax 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1566 c92efa57-630b-4861-b058-cf58834340f0
 2005-01-17 11:46:35 +00:00
cazzato a6ad18850a iswitch flag removed; appropriate flags (as lscf, lmd, lphonon, etc.) should be used 
in particular (modenum.ne.0) stands for iswitch = -4 now: is it OK?
unused show_memory routine also removed
documentation updated


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1503 c92efa57-630b-4861-b058-cf58834340f0
 2004-12-10 15:20:46 +00:00
kokalj d81b6a7d3f adding support for Gaussian cube-file 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1324 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-20 09:17:40 +00:00
kokalj 8f00fd61e4 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1261 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-13 08:49:16 +00:00
kokalj a11390446c - adding variable U_projector_type 
- some spelling corrections


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1259 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-13 08:45:39 +00:00
kokalj 6b7d982a23 - update for PWscf 2.1 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1236 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-04 08:17:22 +00:00
kokalj 2b29f2a1fc - adding support for "intermediate_image" 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1235 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-04 08:14:22 +00:00
kokalj e1875cc341 - adding support for "intermediate_image" 
- adding support for "CONSTRAINTS" card
- disabling the unused variables


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1234 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-04 08:12:44 +00:00
kokalj 2151fd3cd3 - adding support for "intermediate_image" 
- grouping the unused variables


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1233 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-04 08:08:24 +00:00
sbraccia fd8458fe36 GUI has been updated to the new version of pwscf. 
C.S.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1203 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-02 08:10:20 +00:00
kokalj 5baad5e402 preparing for CONSTRAINTS card (code is still commented) 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@788 c92efa57-630b-4861-b058-cf58834340f0
 2004-04-06 14:38:16 +00:00
kokalj 0d3dc13e7b improving the readfilter proc 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@787 c92efa57-630b-4861-b058-cf58834340f0
 2004-04-06 13:41:35 +00:00
kokalj 81bce94034 adding the readfilter proc 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@786 c92efa57-630b-4861-b058-cf58834340f0
 2004-04-06 13:41:09 +00:00
kokalj 7fc4b2d15c adding the readfilter 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@785 c92efa57-630b-4861-b058-cf58834340f0
 2004-04-06 13:38:31 +00:00
kokalj a0902d1592 + fixing typo minization -> minimization 
+ fixing help description of atomic_coordinates2


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@776 c92efa57-630b-4861-b058-cf58834340f0
 2004-04-05 13:45:25 +00:00
kokalj 4fa3894a5e + fixing typo kmin ->k_min 
+ fixing help description of atomic_coordinates2


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@775 c92efa57-630b-4861-b058-cf58834340f0
 2004-04-05 13:45:01 +00:00
kokalj 67ed74a5e8 adapting to tkpwscf --> pwgui change 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@630 c92efa57-630b-4861-b058-cf58834340f0
 2004-02-20 15:16:00 +00:00