.. |
Makefile
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efg removed from Makefile. (D.C.)
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2007-02-22 08:41:22 +00:00 |
add_shift_cc.f90
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Small bug fix in the calculation of initial state
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2007-01-18 21:21:42 +00:00 |
add_shift_lc.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
add_shift_us.f90
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dbl => DP (defined as previously dbl was)
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2005-08-28 14:09:42 +00:00 |
addusdens1d.f90
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dbl => DP (defined as previously dbl was)
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2005-08-28 14:09:42 +00:00 |
atomic_wfc_nc_proj.f90
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Projwfc generalized to noncollinear and spin-orbit cases (still experimental).
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2006-01-20 14:28:51 +00:00 |
average.f90
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More cleanup from Axel:
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2006-12-02 17:58:50 +00:00 |
bands.f90
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Added a routine that writes on file the matrix elements of the p operator.
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2006-12-06 10:39:16 +00:00 |
cft.f90
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dbl => DP (defined as previously dbl was)
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2005-08-28 14:09:42 +00:00 |
cgracsc.f90
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dbl => DP (defined as previously dbl was)
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2005-08-28 14:09:42 +00:00 |
chdens.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
compute_ppsi.f90
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An old version of the compute_ppsi.f90 routine was committed.
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2006-12-06 15:43:27 +00:00 |
compute_sigma_avg.f90
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More cleanup from Axel:
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2006-12-02 17:58:50 +00:00 |
cube.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
cubicspinsym.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
d_matrix_nc.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
d_matrix_so.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
dipole.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
do_initial_state.f90
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Shorthand for Rydberg is Ry, not ryd
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2006-10-23 12:32:54 +00:00 |
do_shift_ew.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
dos.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
dosg.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
elf.f90
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error (..., -1) => infomsg
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2005-08-30 16:27:58 +00:00 |
epsilon.f90
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- bug fix in metal part
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2007-02-09 09:23:17 +00:00 |
ggen1d.f90
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dbl => DP (defined as previously dbl was)
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2005-08-28 14:09:42 +00:00 |
hexspinsym.f90
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Projwfc generalized to noncollinear and spin-orbit cases (still experimental).
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2006-01-20 14:28:51 +00:00 |
initial_state.f90
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getenv replaced by wrapper get_env, preprocessed only in a single file
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2006-10-11 14:42:42 +00:00 |
local_dos.f90
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Wavefunctions in pwscf are stored also for the noncollinear case
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2006-11-27 12:47:25 +00:00 |
local_dos1d.f90
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Wavefunctions in pwscf are stored also for the noncollinear case
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2006-11-27 12:47:25 +00:00 |
local_dos_mag.f90
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Wavefunctions in pwscf are stored also for the noncollinear case
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2006-11-27 12:47:25 +00:00 |
make.depend
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Incorrect call fixed (courtesy of Javad)
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2007-02-14 17:02:32 +00:00 |
openfil_pp.f90
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Incorrect call fixed (courtesy of Javad)
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2007-02-14 17:02:32 +00:00 |
plan_avg.f90
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Wavefunctions in pwscf are stored also for the noncollinear case
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2006-11-27 12:47:25 +00:00 |
plot_io.f90
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Calculation of planar averages of wavefunctions moved out of pp.x
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2006-01-19 17:59:10 +00:00 |
plot_whole_cell.f90
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dbl => DP (defined as previously dbl was)
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2005-08-28 14:09:42 +00:00 |
plotband.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
plotproj.f90
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Small fix and changes. In some cases plotband did not find all the
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2006-09-06 10:03:51 +00:00 |
plotrho.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
poormanwannier.f90
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More patches by Axel: all occurrences of "index" replaced by "idx".
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2006-12-01 14:41:55 +00:00 |
postproc.f90
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getenv replaced by wrapper get_env, preprocessed only in a single file
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2006-10-11 14:42:42 +00:00 |
projwfc.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
punch_plot.f90
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Case plot_num=11 was not working (incorrect call to v_h)
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2006-11-15 18:29:01 +00:00 |
pw2casino.f90
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More patches by Axel: all occurrences of "index" replaced by "idx".
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2006-12-01 14:41:55 +00:00 |
pw2gw.f90
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27.21 => autoev (AXEL)
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2007-01-08 11:50:55 +00:00 |
pw2wannier90.f90
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Incorrect call fixed (courtesy of Javad)
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2007-02-14 17:02:32 +00:00 |
pw_export.f90
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Small changes by Andrea Ferretti: cleanup of unused variable in epsilon.f90,
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2006-10-16 14:57:31 +00:00 |
qexml.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
smallgk.f90
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Now bands.x can classify the bands according to the irreducible
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2006-08-22 17:01:13 +00:00 |
start_postproc.f90
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more init_pool calls removed (already contained in startup)
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2004-03-05 17:42:40 +00:00 |
stm.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
stop_pp.f90
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iuwfc => iunwfc
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2004-12-07 08:25:16 +00:00 |
sumpdos.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
sym_band.f90
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Wavefunctions in pwscf are stored also for the noncollinear case
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2006-11-27 12:47:25 +00:00 |
voronoy.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
wfdd.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |
work_function.f90
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1) v_of_rho has been rearranged in order to reduce the number of FFTs per step.
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2006-07-07 20:16:45 +00:00 |
write_p_avg.f90
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An old version of the compute_ppsi.f90 routine was committed.
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2006-12-06 15:43:27 +00:00 |
xctest.f90
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Modules/functionals.f90 modified.
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2005-11-02 15:42:06 +00:00 |
xsf.f90
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More patches from Axel:
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2006-12-14 08:53:47 +00:00 |