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Makefile
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KS_Solvers directory has been created with three subdirectories:
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2017-07-29 12:19:19 +00:00 |
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allocate_wannier.f90
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Replacing old GWW code with new GWL one.
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2013-07-03 15:24:46 +00:00 |
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calculate_wing.f90
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nl indexes now in fft type
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2017-12-24 16:46:42 +01:00 |
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cgsolve_all_gamma.f90
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ifdef preprocessor macro refactoring (GWW)
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2016-09-18 15:13:03 +00:00 |
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contour_terms.f90
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Variables iunigk and igk deleted from global variables. Beware: may break some
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2016-08-07 13:33:29 +00:00 |
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dft_exchange.f90
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call sequence of fft_interpolate_real and fft_interpolate_complex made equal
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2018-01-03 01:13:20 +01:00 |
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diago_cg.f90
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Standard F2003 calls to: get_environment_variable, get_command_argument,
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2015-09-24 10:24:03 +00:00 |
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diago_cg_g.f90
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Standard F2003 calls to: get_environment_variable, get_command_argument,
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2015-09-24 10:24:03 +00:00 |
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energies_xc.f90
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call sequence of fft_interpolate_real and fft_interpolate_complex made equal
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2018-01-03 01:13:20 +01:00 |
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exchange_custom.f90
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MAJOR restructuring of the FFTXlib library
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2017-08-01 20:31:02 +00:00 |
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fake_conduction.f90
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nl indexes now in fft type
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2017-12-24 16:46:42 +01:00 |
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fft_custom.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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full.f90
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nl indexes now in fft type
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2017-12-24 16:46:42 +01:00 |
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hpsi_pw4gww.f90
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Variables iunigk and igk deleted from global variables. Beware: may break some
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2016-08-07 13:33:29 +00:00 |
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make.depend
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UtilXlib directory created to contain a library (libutil.a) for
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2017-07-26 11:15:20 +00:00 |
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matrix_wannier_gamma.f90
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MAJOR restructuring of the FFTXlib library
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2017-08-01 20:31:02 +00:00 |
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mp_wave_parallel.f90
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Removal of obsolete __PARA preprocessing option
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2015-02-04 16:02:56 +00:00 |
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o_1psi.f90
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nl indexes now in fft type
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2017-12-24 16:46:42 +01:00 |
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o_bands.f90
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Variables iunigk and igk deleted from global variables. Beware: may break some
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2016-08-07 13:33:29 +00:00 |
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o_rinitcgg.f90
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Standard F2003 calls to: get_environment_variable, get_command_argument,
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2015-09-24 10:24:03 +00:00 |
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openfil_pw4gww.f90
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Removal of unused "iunigk" variable
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2016-02-09 15:08:11 +00:00 |
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optimal.f90
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More removal of unused variables
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2016-01-14 21:02:21 +00:00 |
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pola_lanczos.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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pola_partial.f90
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nl indexes now in fft type
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2017-12-24 16:46:42 +01:00 |
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produce_wannier_gamma.f90
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Initial version of the localization algorithm for EXX by Ivan Carnimeo
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2017-08-25 14:36:01 +00:00 |
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pw4gww.f90
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Module pwcom should not contain references to other modules
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2017-05-08 15:26:53 +00:00 |
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realus.f90
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nl indexes now in fft type
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2017-12-24 16:46:42 +01:00 |
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rotate_wannier.f90
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More removal of unused variables
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2016-01-14 21:02:21 +00:00 |
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self_lanczos.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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semicore.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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semicore_read.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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start_pw4gww.f90
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ifdef preprocessor macro refactoring (GWW)
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2016-09-18 15:13:03 +00:00 |
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stop_pp.f90
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ifdef preprocessor macro refactoring (GWW)
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2016-09-18 15:13:03 +00:00 |
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v_basis.f90
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More removal of unused variables
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2016-01-14 21:02:21 +00:00 |
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wannier.f90
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More removal of unused variables
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2016-01-14 21:02:21 +00:00 |
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wannier_bse.f90
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Variables iunigk and igk deleted from global variables. Beware: may break some
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2016-08-07 13:33:29 +00:00 |
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wannier_uterms.f90
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Variables iunigk and igk deleted from global variables. Beware: may break some
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2016-08-07 13:33:29 +00:00 |
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wfc_real.f90
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nl indexes now in fft type
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2017-12-24 16:46:42 +01:00 |
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write_vpot_matrix.f90
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Medium: GWL did not work if outdir was set in PW. This is a simple workaround. Probably someone should recode to integrate diropn for compatibility reasons.
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2014-02-26 10:03:59 +00:00 |
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write_wannier_matrix.f90
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Medium: GWL did not work if outdir was set in PW. This is a simple workaround. Probably someone should recode to integrate diropn for compatibility reasons.
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2014-02-26 10:03:59 +00:00 |
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