quantum-espresso/Modules
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
..
Makefile Cleanup [Gerardo] 2003-12-02 15:47:00 +00:00
basic_algebra_routines.f90 Fixed a problem that prevents from compiling on sp4. 2003-12-02 14:22:16 +00:00
berry_phase.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
bfgs_module.f90 Several bugs fixed in neb (CI_scheme = 'manual') and in the way c_mkdir was called. 2003-12-06 10:32:04 +00:00
cell_base.f90 more merging, "only" keyword added to many "use" 2003-07-06 21:47:17 +00:00
clocks.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
constants.f90 Added eps16 (1.0D-16) and eps32 (1.0D-32). 2003-11-05 11:35:48 +00:00
control_flags.f90 - io_base logic simplified 2003-08-24 22:25:53 +00:00
descriptors.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
electrons_base.f90 more merging, "only" keyword added to many "use" 2003-07-06 21:47:17 +00:00
energies.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
fft_base.f90 - common subroutine sph_bes linked to the CP in place 2003-05-26 22:02:26 +00:00
fft_scalar.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
fft_types.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
griddim.f90 More common modules for grid dimensioning, 2003-06-24 21:38:49 +00:00
input_parameters.f90 PW, Gamma and NEB are now unified. 2003-12-10 14:57:07 +00:00
io_base.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
io_files.f90 Documentation updated to reflect merge of Gamma and k-point versions 2003-12-11 11:10:03 +00:00
io_global.f90 iunsdtout removed by PW/pwcom.f90. The unit for standar output (stdout) 2003-11-03 18:13:21 +00:00
ions_base.f90 more merging, "only" keyword added to many "use" 2003-07-06 21:47:17 +00:00
kind.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
miscellany.f90 Module miscellany moved from NEB to Modules. C.S. 2003-11-21 10:04:11 +00:00
mp.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
mp_buffers.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
mp_global.f90 O-sesame 2003-01-19 21:58:50 +00:00
mp_wave.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
parallel_include.f90 O-sesame 2003-01-19 21:58:50 +00:00
parallel_types.f90 More merging: modules energies and control_flags of FPMD and CPV 2003-06-09 21:27:20 +00:00
parameters.f90 FPMD: 2003-07-21 15:59:32 +00:00
parser.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
pseudo_types.f90 - File mp_buffers.f90 and ptoolkit.f90 moved to Module directory 2003-03-02 23:19:44 +00:00
pseudodata.f90 O-sesame 2003-01-19 21:58:50 +00:00
ptoolkit.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
read_cards.f90 Yet another bug in CI_scheme = 'manual' (neb code). 2003-12-09 08:16:59 +00:00
read_namelists.f90 spin-polarized calculations: at least one value for 2003-12-02 14:28:22 +00:00
readpseudo.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
recvec.f90 - unit 6 replaced by stdout in CPV 2003-11-09 10:42:50 +00:00
shmem_include.f90 SAVE attribute added. 2003-10-21 13:37:54 +00:00
smallbox.f90 More common modules for grid dimensioning, 2003-06-24 21:38:49 +00:00
stick_base.f90 Unit stdout (set in io_global.f90) is used to write on standard output 2003-11-04 10:26:03 +00:00
version.f90 Version number updated to 1.3.1 2003-11-04 09:32:24 +00:00
wavefunctions.f90 - unit 6 replaced by stdout in CPV 2003-11-09 10:42:50 +00:00