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Makefile
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First compiling version of QE with initial "pseudolib" in upflib/.
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2020-04-25 19:13:15 +00:00 |
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a_h.f90
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Out-of-bound error when converting (tot,magn) to (up,down) rho.
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2019-06-06 12:52:16 +00:00 |
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cg_readin.f90
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Some cleanup of the Gamma phonon code
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2019-01-23 12:03:36 +01:00 |
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cg_setup.f90
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Removal of useless calls
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2020-03-12 15:01:06 +01:00 |
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cgcom.f90
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Out-of-bound error when converting (tot,magn) to (up,down) rho.
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2019-06-06 12:52:16 +00:00 |
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cgsolve.f90
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npw should no longer ne used as global variabe
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2017-05-25 14:08:31 +00:00 |
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d2ion.f90
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More mp_global cleanup: PHonon, GWW
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2019-01-31 22:09:24 +01:00 |
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dgradcorr.f90
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Out-of-bound error when converting (tot,magn) to (up,down) rho.
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2019-06-06 12:52:16 +00:00 |
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dielec.f90
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More mp_global cleanup: PHonon, GWW
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2019-01-31 22:09:24 +01:00 |
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drhodv.f90
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More mp_global cleanup: PHonon, GWW
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2019-01-31 22:09:24 +01:00 |
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dvb_cc.f90
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new interface to fft calls
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2018-01-02 17:45:45 +01:00 |
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dvpsi_e.f90
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Rename module wavefunctions_module to wavefunctions
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2018-07-12 16:11:48 +02:00 |
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dvpsi_kb.f90
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Rename module wavefunctions_module to wavefunctions
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2018-07-12 16:11:48 +02:00 |
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dyndiar.f90
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Revert "Merge branch 'revert-c25e9f31' into 'develop'"
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2020-02-01 09:14:20 +00:00 |
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dynmat_init.f90
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Cleanup: USE pwcom replaced by USE 'specific module',only: 'list of variables'
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2015-11-18 09:12:21 +00:00 |
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dynmatcc.f90
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More mp_global cleanup: PHonon, GWW
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2019-01-31 22:09:24 +01:00 |
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find_equiv_sites.f90
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Removed fixed dimensions "nax". Note that this changes the way routine
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2012-11-23 11:02:28 +00:00 |
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generate_dynamical_matrix.f90
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PH re-structured. PH Now called PHonon, D3 and Gamma moved to dir PHonon
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2011-09-21 13:43:24 +00:00 |
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generate_effective_charges.f90
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PH re-structured. PH Now called PHonon, D3 and Gamma moved to dir PHonon
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2011-09-21 13:43:24 +00:00 |
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h_h.f90
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npw should no longer ne used as global variabe
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2017-05-25 14:08:31 +00:00 |
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macro.f90
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More minor cleanup of indices
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2016-05-30 13:55:52 +00:00 |
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make.depend
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First compiling version of QE with initial "pseudolib" in upflib/.
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2020-04-25 19:13:15 +00:00 |
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phcg.f90
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input_drho and output_drho removed where not used, micro-doc added
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2020-09-17 20:58:52 +02:00 |
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rhod2vkb.f90
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More mp_global cleanup: PHonon, GWW
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2019-01-31 22:09:24 +01:00 |
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solve_e.f90
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Rename module wavefunctions_module to wavefunctions
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2018-07-12 16:11:48 +02:00 |
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solve_ph.f90
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Several print format extended to allow more than 999 phonon modes (!)
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2020-03-26 09:23:34 +01:00 |
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writedyn.f90
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Yet another bug in dynamical matrix writing in Gamma-only phonon code
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2016-05-09 06:02:50 +00:00 |
76a0e6b330