.. |
Makefile
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configure updated (only configure.ac had been previously updated).
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2007-06-20 17:04:47 +00:00 |
apply_p.f90
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- changed all 'nmr_*' and 'magn_*' into 'gipaw_*' for all references to the
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2007-01-15 11:45:23 +00:00 |
apply_vel.f90
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Trying to stay up-to-date with the recent CVS changes. Gipaw compiles
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2007-02-23 15:32:08 +00:00 |
biot_savart.f90
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- Changed from 'c' to 'alpha' as the units
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2007-01-17 14:37:20 +00:00 |
cg_psi.f90
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GIPAW should not depend on PH! I've just borrowed few routines.
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2007-03-19 09:38:11 +00:00 |
cgsolve_all.f90
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GIPAW should not depend on PH! I've just borrowed few routines.
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2007-03-19 09:38:11 +00:00 |
ch_psi_all.f90
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GIPAW should not depend on PH! I've just borrowed few routines.
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2007-03-19 09:38:11 +00:00 |
compute_sigma.f90
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Print total isotropic chemical shift. (D.C.)
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2007-03-29 09:25:39 +00:00 |
compute_u_kq.f90
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Small change. (D.C.)
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2007-04-02 08:22:12 +00:00 |
efg.f90
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Hyper-fine interactions implemented; seem to work for CN molecule. No
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2007-05-10 12:27:45 +00:00 |
g_tensor_crystal.f90
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Removed commented, obsolete old USE statement
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2007-06-28 15:18:15 +00:00 |
gipaw_main.f90
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Hyper-fine interactions implemented; seem to work for CN molecule. No
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2007-05-10 12:27:45 +00:00 |
gipaw_module.f90
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Hyper-fine interactions implemented; seem to work for CN molecule. No
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2007-05-10 12:27:45 +00:00 |
greenfunction.f90
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Finally got GIPAW working again! Actually, by working I mean "running"
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2007-03-19 13:48:57 +00:00 |
h_psiq.f90
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GIPAW should not depend on PH! I've just borrowed few routines.
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2007-03-19 09:38:11 +00:00 |
init_paw_2_no_phase.f90
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Changed the data types in the PAW reconstruction; now there is one major
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2007-02-21 16:54:18 +00:00 |
init_us_2_no_phase.f90
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Splines are disabled by default, but now they are
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2007-01-25 11:42:52 +00:00 |
j_para.f90
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- changed all 'nmr_*' and 'magn_*' into 'gipaw_*' for all references to the
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2007-01-15 11:45:23 +00:00 |
make.depend
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Misc updates: configure (mac intel + ifort), make.depend, Makefiles
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2007-04-10 20:39:42 +00:00 |
stop_code.f90
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Initial release (previously developed against tag QE-3-1-1 in directory
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2007-01-15 11:29:24 +00:00 |
suscept_crystal.f90
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Small changes. (D.C.)
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2007-05-15 09:18:06 +00:00 |
sym_cart_tensor.f90
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Initial release (previously developed against tag QE-3-1-1 in directory
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2007-01-15 11:29:24 +00:00 |
symmetrize_field.f90
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- changed all 'nmr_*' and 'magn_*' into 'gipaw_*' for all references to the
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2007-01-15 11:45:23 +00:00 |
test_sum_rule.f90
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Finally got GIPAW working again! Actually, by working I mean "running"
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2007-03-19 13:48:57 +00:00 |
write_tensor_field.f90
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- changed all 'nmr_*' and 'magn_*' into 'gipaw_*' for all references to the
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2007-01-15 11:45:23 +00:00 |