paulatto dce5f820da Paw code moved around and unused functions removed; old grid_paw code removed. ... This is the first step of code cleanup. Actually nothing should change. rad_paw_routines -> paw_onecenter (2 functions went to paw_init) grid_paw_variables -> paw_variables (with some additions from rad_paw_routines) grid_paw_routines -> paw_init (merged with 2 init functions from rad_paw) Probably there are a few random fixes around. Next step: remove ndmx and ntpx. LP git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@4422 c92efa57-630b-4861-b058-cf58834340f0		2007-11-12 14:49:09 +00:00
..
Makefile	Paw code moved around and unused functions removed; old grid_paw code removed.	2007-11-12 14:49:09 +00:00
allocate_cond.f90	Experimental: pwcond calculates the scattering and Bloch states on a 3D-FFT	2006-10-25 15:35:53 +00:00
bessj.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
compbs.f90	Experimental: pwcond calculates the scattering and Bloch states on a 3D-FFT	2006-10-25 15:35:53 +00:00
compbs_2.f90	Several arrays with zero dimension are not allocated in the free electrons	2006-10-16 15:25:42 +00:00
cond_out.f90	Small change: stdout used everywhere in pwcond.	2006-05-15 07:57:15 +00:00
condcom.f90	Parameter nbrx (max number of beta functions) removed. Exceptions:	2007-10-15 16:37:00 +00:00
condmain.f90	Program for complex bands and conductance calculation.	2003-09-24 10:03:55 +00:00
do_cond.f90	The variables needed to constrain the magnetization written in the punch	2007-07-28 16:40:41 +00:00
eigenchnl.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
form_zk.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
four.f90	a radial_grid_type is introduced in Modules and used in atomic-related part	2007-08-12 00:08:53 +00:00
free_mem.f90	Several arrays with zero dimension are not allocated in the free electrons	2006-10-16 15:25:42 +00:00
gep_x.f90	Cleanup of obsolete stuff	2005-10-04 14:08:10 +00:00
gramsh.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
hev_ab.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
init_cond.f90	Two fixes for PWCOND: pseudopotentials are dimensioned up to the actual	2007-10-07 17:34:26 +00:00
init_gper.f90	Experimental feature: pwcond is used to calculate the propagating Bloch states	2006-10-18 15:37:43 +00:00
init_orbitals.f90	Two fixes for PWCOND: pseudopotentials are dimensioned up to the actual	2007-10-07 17:34:26 +00:00
integrals.f90	More patches from Axel:	2006-12-14 08:53:47 +00:00
jbloch.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
kbloch.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
local.f90	More patches by Axel: all occurrences of "index" replaced by "idx".	2006-12-01 14:41:55 +00:00
local_set.f90	Modified the transmission code PWCOND so that now it works	2005-01-28 17:10:20 +00:00
make.depend	make.depend again and a corrected scf_mod.f90	2007-10-31 23:02:23 +00:00
poten.f90	module scf has been separated from PW/pwcom.f90 (put in PW/scf_mod.f90) in	2007-10-31 14:28:18 +00:00
print_clock_pwcond.f90	pwcond can now deal with spinor wavefunctions and with	2004-11-01 09:26:40 +00:00
rotproc.f90	MPI_REAL8 => MPI_DOUBLE_PRECISION	2006-09-21 10:32:04 +00:00
save_cond.f90	Parameter nbrx (max number of beta functions) removed. Exceptions:	2007-10-15 16:37:00 +00:00
scatter_forw.f90	Parameter nbrx (max number of beta functions) removed. Exceptions:	2007-10-15 16:37:00 +00:00
summary_band.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
summary_tran.f90	Modified the transmission code PWCOND so that now it works	2005-01-28 17:10:20 +00:00
sunitary.f90	dbl => DP (defined as previously dbl was)	2005-08-28 14:09:42 +00:00
transmit.f90	Experimental: pwcond calculates the scattering and Bloch states on a 3D-FFT	2006-10-25 15:35:53 +00:00
write_states.f90	Write_states now writes also the charge of spinor wavefunctions.	2006-10-26 13:52:15 +00:00