scnc
/
quantum-espresso
mirror of https://gitlab.com/QEF/q-e.git
1
0
Fork 0
Code Issues Packages Projects Releases Wiki Activity
1,691 Commits 5 Branches 40 Tags 1.8 GiB
Commit Graph

12 Commits

Author SHA1 Message Date
giannozz 1648ab6bf2 Patches from Axel Kohlmayer: 
- iotk_scan in iotk_module had a mixed up 'intent' statement.
- sun ultra fire 3 compiler warnings
- cleanup in filename length (brought to 256)
- cleanup in include files


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1399 c92efa57-630b-4861-b058-cf58834340f0
 2004-10-26 09:32:48 +00:00
sbraccia a05a93b24b matdyn.f90 q2r.f90 modified to work in a parallel environment (only the first cpu does the job). 
C.S.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1342 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-27 12:16:41 +00:00
sbraccia 0caeadbd7b Machine-dependent definitions are now contained in two different files (both in /include): 
1) f_defs.h  for definitions to be included in FORTRAN files ONLY
   2) c_defs.h  for definitions to be included in C       files ONLY

C.S.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1012 c92efa57-630b-4861-b058-cf58834340f0
 2004-06-25 17:25:37 +00:00
giannozz 839d8fec7b uffa... 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1009 c92efa57-630b-4861-b058-cf58834340f0
 2004-06-25 16:30:52 +00:00
giannozz ee61e86345 iargc explicitely declared 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@926 c92efa57-630b-4861-b058-cf58834340f0
 2004-05-28 10:29:52 +00:00
ballabio 3e444c17ea more "program -in input" added [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@923 c92efa57-630b-4861-b058-cf58834340f0
 2004-05-27 16:54:20 +00:00
cavazzon de9a865b6c subroutine latgen and volume moved to flib 
and used by all codes,
as common latgen it has been used the one contained in CPV,
sice this version solve some problems related to left-handed cell

new common module ions_base with ionic basic variables


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@247 c92efa57-630b-4861-b058-cf58834340f0
 2003-06-25 12:43:25 +00:00
cavazzon 236a0a42f3 tools fft linked to the module fft_scalar.f90 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@193 c92efa57-630b-4861-b058-cf58834340f0
 2003-04-29 10:09:51 +00:00
giannozz be52103a27 All filenames => 80 char 
All directories=> 80 char
Filenames + directories + other => 256
---------------------------------------------------------------


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@154 c92efa57-630b-4861-b058-cf58834340f0
 2003-04-12 19:25:08 +00:00
giannozz 9e3a2de758 Support for lahey compiler added: "error" renamed to "errore", "rnd" to "rndx" 
bug in io_base fixed
PARA => __PARA
cinterpolate moved into interpolate


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@86 c92efa57-630b-4861-b058-cf58834340f0
 2003-02-21 14:57:00 +00:00
giannozz ca99628b72 better checks for q2r 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@59 c92efa57-630b-4861-b058-cf58834340f0
 2003-02-10 16:29:57 +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