scnc
/
quantum-espresso
mirror of https://gitlab.com/QEF/q-e.git
1
0
Fork 0
Code Issues Packages Projects Releases Wiki Activity
quantum-espresso/PWCOND
History
dalcorso 43ac7466b7 Bug fix: In particular cases the order of the orbitals was not correct. 
(A. Smogunov and ADC) (Bug found by G. Sclauzero).


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3151 c92efa57-630b-4861-b058-cf58834340f0
 		2006-06-05 07:49:05 +00:00
..
Makefile Missing electrons_base.o 2006-05-16 21:06:38 +00:00
allocate_cond.f90 Modified the transmission code PWCOND so that now it works 2005-01-28 17:10:20 +00:00
bessj.f90 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +00:00
compbs.f90 Cleanup of obsolete stuff 2005-10-04 14:08:10 +00:00
compbs_2.f90 Small change: stdout used everywhere in pwcond. 2006-05-15 07:57:15 +00:00
cond_out.f90 Small change: stdout used everywhere in pwcond. 2006-05-15 07:57:15 +00:00
condcom.f90 Introduced the possibility to generate a grid of 2D k-points. 2006-05-15 08:05:55 +00:00
condmain.f90 Program for complex bands and conductance calculation. 2003-09-24 10:03:55 +00:00
do_cond.f90 Introduced the possibility to generate a grid of 2D k-points. 2006-05-15 08:05:55 +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 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +00:00
free_mem.f90 Modified the transmission code PWCOND so that now it works 2005-01-28 17:10:20 +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 Small change: stdout used everywhere in pwcond. 2006-05-15 07:57:15 +00:00
init_gper.f90 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +00:00
init_orbitals.f90 Bug fix: In particular cases the order of the orbitals was not correct. 2006-06-05 07:49:05 +00:00
integrals.f90 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +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 Missing #ifdef __PARA. 2006-05-05 05:33:43 +00:00
local_set.f90 Modified the transmission code PWCOND so that now it works 2005-01-28 17:10:20 +00:00
poten.f90 Small change: stdout used everywhere in pwcond. 2006-05-15 07:57:15 +00:00
print_clock_pwcond.f90 pwcond can now deal with spinor wavefunctions and with 2004-11-01 09:26:40 +00:00
rotate.f90 Clean-up of unused variables. 2006-05-19 15:21:27 +00:00
rotproc.f90 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +00:00
save_cond.f90 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +00:00
scatter_back.f90 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +00:00
scatter_forw.f90 dbl => DP (defined as previously dbl was) 2005-08-28 14:09:42 +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 Small change: stdout used everywhere in pwcond. 2006-05-15 07:57:15 +00:00