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Makefile
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PW/src PW/tools compiling makedeps updated
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2011-12-14 17:33:33 +00:00 |
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bcast_lr_input.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_alloc_init.f90
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Reverting commit 7984.
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2011-07-17 17:56:31 +00:00 |
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lr_apply_liouvillian.f90
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- grid data structure merged with the fft data structure.
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2011-07-14 22:14:15 +00:00 |
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lr_calc_dens.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_charg_resp.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_dealloc.f90
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Improving code readability: ran src-normal on the TDDFPT src.
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2011-05-03 13:47:30 +00:00 |
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lr_diagonalise.f90
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Improving code readability: ran src-normal on the TDDFPT src.
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2011-05-03 13:47:30 +00:00 |
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lr_dot.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_dv_setup.f90
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Modernizing the PH code interface. This update:
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2011-05-12 12:13:52 +00:00 |
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lr_dvpsi_e.f90
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h_psiq hack: I think it is preferrable to give to igkq the correct value
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2012-02-15 20:31:07 +00:00 |
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lr_init_nfo.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_lanczos.f90
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Improving code readability: Removed some of the more verbose output options from TDDFPT code.
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2011-05-03 14:52:33 +00:00 |
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lr_main.f90
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Implemented the max_seconds option in turboTDDFT. The code will now exit gracefully after a given amount of wall time has elapsed saving *all* of the Lanczos coeffs generated to that point.
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2012-03-22 16:37:27 +00:00 |
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lr_normalise.f90
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Improving code readability: ran src-normal on the TDDFPT src.
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2011-05-03 13:47:30 +00:00 |
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lr_ortho.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_read_d0psi.f90
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Improving code readability: ran src-normal on the TDDFPT src.
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2011-05-03 13:47:30 +00:00 |
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lr_read_wf.f90
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Some tidying of the input parser and setup routines in TDDFPT. Also moved all of the input sanity checks to a dedicated routine.
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2011-12-14 15:30:35 +00:00 |
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lr_readin.f90
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Implemented the max_seconds option in turboTDDFT. The code will now exit gracefully after a given amount of wall time has elapsed saving *all* of the Lanczos coeffs generated to that point.
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2012-03-22 16:37:27 +00:00 |
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lr_restart.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_set_boxes_density.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_sm1_psi.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_solve_e.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_variables.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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lr_write_restart.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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make.depend
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update make.depend
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2012-04-04 12:35:19 +00:00 |
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print_clock_lr.f90
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No reason to have both __PARA and __MPI preprocessing options: they have the same meaning. __MPI is more explicit, so I am keeping it
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2012-02-02 22:12:26 +00:00 |
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sd0psi.f90
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Improving code readability: ran src-normal on the TDDFPT src.
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2011-05-03 13:47:30 +00:00 |
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stop_lr.f90
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Implemented the max_seconds option in turboTDDFT. The code will now exit gracefully after a given amount of wall time has elapsed saving *all* of the Lanczos coeffs generated to that point.
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2012-03-22 16:37:27 +00:00 |
f5f506651f