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23 Commits

Author SHA1 Message Date
giannozz 058dd72d74 Minor updates 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2471 c92efa57-630b-4861-b058-cf58834340f0
 2005-11-14 08:50:12 +00:00
giannozz 3345d18428 Final output of configure is somewhat less confusing 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2208 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-22 16:20:09 +00:00
cavazzon 41c665b82b - Executable fpmd.x no more built, new calculation "fpmd" added, to 
execute cp.x with fpmd flavour
 - stress for LSD calculation fixed ( but more test required )


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2190 c92efa57-630b-4861-b058-cf58834340f0
 2005-09-18 23:49:24 +00:00
giannozz 30e9ab72c7 ESPRESSO => Quantum-ESPRESSO 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1563 c92efa57-630b-4861-b058-cf58834340f0
 2005-01-15 20:46:38 +00:00
giannozz c015af1f3c All mentions of obsolete directory PWNC/ removed 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1542 c92efa57-630b-4861-b058-cf58834340f0
 2005-01-05 17:23:07 +00:00
cavazzon 87700b86cc - some more changes relative to FPMD files 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1481 c92efa57-630b-4861-b058-cf58834340f0
 2004-11-25 15:43:24 +00:00
giannozz f17501572d Support for mac-osx added (contributed by Pascal Thibaudeau) 
Extensive documentation update and reshuffling : pwdocs and cpdocs merged
into Doc


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1104 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-09 16:35:51 +00:00
ballabio 34f3a80c40 small fixes/cleanup [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@947 c92efa57-630b-4861-b058-cf58834340f0
 2004-06-10 14:58:51 +00:00
kokalj 55a81f9f60 correcting text for GUI 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@668 c92efa57-630b-4861-b058-cf58834340f0
 2004-02-24 17:51:19 +00:00
kokalj 626707d4ed adapting to tkpwscf --> pwgui change 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@631 c92efa57-630b-4861-b058-cf58834340f0
 2004-02-20 15:21:16 +00:00
giannozz 0cee77cee0 More last-minute fixes... 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@629 c92efa57-630b-4861-b058-cf58834340f0
 2004-02-20 09:56:53 +00:00
giannozz 384b771828 Berry-Phase calculation in parallel fixed for npool = 1, 
program stops if npool > 1.  Misc doc updates


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@614 c92efa57-630b-4861-b058-cf58834340f0
 2004-02-18 14:28:27 +00:00
giannozz 1286ba43d1 Documentation updated, some changes to output in dynamics and in summary 
as requested by Tone - examples updated with the exception of example12
(please verify if they are ok). Version number updated to 2.0 .
configure => configure.old, configure.new => configure


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@553 c92efa57-630b-4861-b058-cf58834340f0
 2004-02-03 12:08:55 +00:00
giannozz 7c4f3cf840 Documentation updated to reflect merge of Gamma and k-point versions 
variable filpun removed everywhere


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@454 c92efa57-630b-4861-b058-cf58834340f0
 2003-12-11 11:10:03 +00:00
giannozz ea67299117 CP + UPF bug fixed, examples updated, name cpv changed to cp, etc etc 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@45 c92efa57-630b-4861-b058-cf58834340f0
 2003-02-02 17:52:18 +00:00
giannozz daca8a5f58 cpv: added check on dimension of pseudopotential arrays, temporarily 
removed check on gamma_only, configure and cp_examples fixed


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@44 c92efa57-630b-4861-b058-cf58834340f0
 2003-02-01 12:01:35 +00:00
giannozz 4d8bb08b2f Le virgolette '' confondono certi compilatori ... 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@38 c92efa57-630b-4861-b058-cf58834340f0
 2003-01-29 14:04:02 +00:00
giannozz 90645c698b Ultimi dettagli, 1.2.0 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@35 c92efa57-630b-4861-b058-cf58834340f0
 2003-01-29 09:37:09 +00:00
giannozz 522ecf435e Minor things 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@31 c92efa57-630b-4861-b058-cf58834340f0
 2003-01-28 20:21:46 +00:00
giannozz c9436b394c Manual added and (partially) updated 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@21 c92efa57-630b-4861-b058-cf58834340f0
 2003-01-26 18:25:59 +00:00
giannozz 99d3a31e2e Makefiles modified to work if some directory is missing 
INSTALL file added, pwdocs/INSTALL.obsolete obsoleted,
README worth reading, misc. cleaning


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@20 c92efa57-630b-4861-b058-cf58834340f0
 2003-01-25 18:05:41 +00:00
giannozz 78ddef1f56 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@8 c92efa57-630b-4861-b058-cf58834340f0
 2003-01-20 13:37:17 +00:00
giannozz ac9f2144c0 O-sesame 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@2 c92efa57-630b-4861-b058-cf58834340f0
 2003-01-19 21:58:50 +00:00