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Makefile
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dylmr2.f90 moved to flib/
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2004-04-20 14:45:00 +00:00 |
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allocate_d3.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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bcast_d3_input.f90
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- missing use of iverbosity
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2004-04-03 14:42:28 +00:00 |
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ch_psi_all2.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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close_open.f90
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Documentation updated to reflect merge of Gamma and k-point versions
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2003-12-11 11:10:03 +00:00 |
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d0rhod2v.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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d2mxc.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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d3_exc.f90
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The array of communicators was non necessary (thanks to SdG): removed everywhere.
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2004-03-24 16:30:44 +00:00 |
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d3_init.f90
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1) An experimental parallelization of NEB images has been implemented.
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2004-03-24 09:36:50 +00:00 |
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d3_readin.f90
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Cleanup: all references to varie replaced by references to control_flags
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2004-04-02 13:01:15 +00:00 |
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d3_recover.f90
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calls to mpi_bcast replaced by calls to interface mp_bicast
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2003-03-24 15:25:17 +00:00 |
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d3_setup.f90
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Cleanup: all references to varie replaced by references to control_flags
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2004-04-02 13:01:15 +00:00 |
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d3_summary.f90
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Cleanup: all references to varie replaced by references to control_flags
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2004-04-02 13:01:15 +00:00 |
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d3_symdyn.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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d3_symdynph.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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d3_valence.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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d3com.f90
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Extensive module cleanup: DP moved from wrong place (parameters) to the
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2004-01-23 15:08:03 +00:00 |
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d3dyn_cc.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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d3ionq.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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d3matrix.f90
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Cleanup: all references to varie replaced by references to control_flags
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2004-04-02 13:01:15 +00:00 |
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d3toten.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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d3vrho.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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davcio_drho2.f90
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The array of communicators was non necessary (thanks to SdG): removed everywhere.
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2004-03-24 16:30:44 +00:00 |
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dpsi_corr.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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dpsidpsidv.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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dpsidvdpsi.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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dqrhod2v.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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drho_cc.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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drho_drc.f90
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1) An experimental parallelization of NEB images has been implemented.
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2004-03-24 09:36:50 +00:00 |
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drhod2v.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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dvdpsi.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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dvscf.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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gen_dpdvp.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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gen_dwfc.f90
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Unit stdout (set in Modules/io_global.f90) is used to write on standard output
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2003-11-06 13:06:49 +00:00 |
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incdrhoscf2.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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openfild3.f90
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Documentation updated to reflect merge of Gamma and k-point versions
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2003-12-11 11:10:03 +00:00 |
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print_clock_d3.f90
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Unit stdout (set in Modules/io_global.f90) is used to write on standard output
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2003-11-06 13:06:49 +00:00 |
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psymd0rho.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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qstar_d3.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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read_ef.f90
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calls to mpi_bcast replaced by calls to interface mp_bicast
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2003-03-24 15:25:17 +00:00 |
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rotate_and_add_d3.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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set_d3irr.f90
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Cleanup: all references to varie replaced by references to control_flags
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2004-04-02 13:01:15 +00:00 |
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set_efsh.f90
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More postprocessing is working at Gamma point.
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2004-03-12 18:38:54 +00:00 |
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set_sym_irr.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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sgama_d3.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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solve_linter_d3.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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stop_d3.f90
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1) An experimental parallelization of NEB images has been implemented.
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2004-03-24 09:36:50 +00:00 |
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sym_def1.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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symd0rho.f90
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Cleanup in PH/ and D3/, setv removed (please verify collateral damages!)
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2004-03-07 13:47:42 +00:00 |
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trntnsc_3.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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w_1gauss.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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write_aux.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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write_d3dyn.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
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write_igk.f90
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- bug (alpha compiler) reported by Sergey has been fixed
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2003-11-09 18:30:08 +00:00 |
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writed3dyn_5.f90
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4 feb 2004 D3 code updated to work with max_irr_dim != 3, some cleanup.
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2004-02-04 11:06:45 +00:00 |
0c2d41eeec