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Name Date Size #Lines LOC

..27-Jan-2021-

READMEH A D27-Jan-2021410 127

cdf2dm.F90H A D27-Jan-20213.3 KiB11231

dm2cdf.F90H A D27-Jan-20215 KiB16148

dmUnblock.F90H A D27-Jan-20215.3 KiB200102

dm_noncol_sign_flip4.f90H A D27-Jan-20212.5 KiB10924

dmbs2dm.F90H A D27-Jan-20214.9 KiB18899

dmfilter.f90H A D27-Jan-20213.3 KiB13340

f2kcli.F90H A D27-Jan-20218.4 KiB23586

m_getopts.f90H A D27-Jan-20216 KiB20379

makefileH A D27-Jan-20212 KiB7326

read_dm.mH A D27-Jan-2021867 4032

read_dmhs.mH A D27-Jan-20211.3 KiB4840

README

1Utilities to convert between the classic DM and netCDF format, and to
2filter the contribution of certain orbitals to the DM.
3
4Also, experimental octave scripts to read DM.nc and DMHS.nc files.
5
6dmbs2dm and dmUnblock are used to convert "blocked" DM (or H or S)
7files to the classic Siesta format.
8
9To allow reuse of non-collinear DM files produced with versions <
104.0.2, use the program dm_noncol_sign_flip4.
11
12