quantum-espresso/PHonon/Gamma
Paolo Giannozzi ebbb788aa8 No need to add a new variable "isolveph" containing information on the
diagonalization for the phonon code: existing variable "isolve" does the job.
make.depend updated
2019-08-07 19:46:20 +02:00
..
Makefile Out-of-bound error when converting (tot,magn) to (up,down) rho. 2019-06-06 12:52:16 +00:00
a_h.f90 Out-of-bound error when converting (tot,magn) to (up,down) rho. 2019-06-06 12:52:16 +00:00
cg_readin.f90 Some cleanup of the Gamma phonon code 2019-01-23 12:03:36 +01:00
cg_setup.f90 init_xc removed except in funct.f90 and other adjustments 2019-06-10 16:00:23 +00:00
cgcom.f90 Out-of-bound error when converting (tot,magn) to (up,down) rho. 2019-06-06 12:52:16 +00:00
cgsolve.f90 npw should no longer ne used as global variabe 2017-05-25 14:08:31 +00:00
d2ion.f90 More mp_global cleanup: PHonon, GWW 2019-01-31 22:09:24 +01:00
dgradcorr.f90 Out-of-bound error when converting (tot,magn) to (up,down) rho. 2019-06-06 12:52:16 +00:00
dielec.f90 More mp_global cleanup: PHonon, GWW 2019-01-31 22:09:24 +01:00
drhodv.f90 More mp_global cleanup: PHonon, GWW 2019-01-31 22:09:24 +01:00
dvb_cc.f90 new interface to fft calls 2018-01-02 17:45:45 +01:00
dvpsi_e.f90 Rename module wavefunctions_module to wavefunctions 2018-07-12 16:11:48 +02:00
dvpsi_kb.f90 Rename module wavefunctions_module to wavefunctions 2018-07-12 16:11:48 +02:00
dyndiar.f90 - LAXlib made independent from other module 2019-08-07 14:27:02 +02:00
dynmat_init.f90 Cleanup: USE pwcom replaced by USE 'specific module',only: 'list of variables' 2015-11-18 09:12:21 +00:00
dynmatcc.f90 More mp_global cleanup: PHonon, GWW 2019-01-31 22:09:24 +01:00
find_equiv_sites.f90 Removed fixed dimensions "nax". Note that this changes the way routine 2012-11-23 11:02:28 +00:00
generate_dynamical_matrix.f90 PH re-structured. PH Now called PHonon, D3 and Gamma moved to dir PHonon 2011-09-21 13:43:24 +00:00
generate_effective_charges.f90 PH re-structured. PH Now called PHonon, D3 and Gamma moved to dir PHonon 2011-09-21 13:43:24 +00:00
h_h.f90 npw should no longer ne used as global variabe 2017-05-25 14:08:31 +00:00
macro.f90 More minor cleanup of indices 2016-05-30 13:55:52 +00:00
make.depend No need to add a new variable "isolveph" containing information on the 2019-08-07 19:46:20 +02:00
phcg.f90 init_xc removed except in funct.f90 and other adjustments 2019-06-10 16:00:23 +00:00
rhod2vkb.f90 More mp_global cleanup: PHonon, GWW 2019-01-31 22:09:24 +01:00
solve_e.f90 Rename module wavefunctions_module to wavefunctions 2018-07-12 16:11:48 +02:00
solve_ph.f90 Rename module wavefunctions_module to wavefunctions 2018-07-12 16:11:48 +02:00
writedyn.f90 Yet another bug in dynamical matrix writing in Gamma-only phonon code 2016-05-09 06:02:50 +00:00