| 2016-10-06 01:18:01 |
Chao Lian |
bug |
|
|
added bug |
| 2016-10-06 04:05:48 |
Chao Lian |
description |
if ( nbcell == 2 ) then
! Note that we enable the correction if there is an
! external field
dipole_correction = fdf_boolean("SlabDipoleCorrection",
& .false.)
if (acting_efield .and. (.not. dipole_correction)) then
if (ionode) write(6,'(/,(a))')
. 'efield: SlabDipoleCorrection turned on automatically',
. 'efield: when an external electric field is applied.',
. 'efield: For backward compatibility, set if to .false.'
dipole_correction = .true.
endif
else
dipole_correction = .false.
end if
This code in m_efield.F always use True to overwrite the dipole_correction, no matter what user set, making it impossible to set it to false. |
if ( nbcell == 2 ) then
! Note that we enable the correction if there is an
! external field
dipole_correction = fdf_boolean("SlabDipoleCorrection",
& .false.)
if (acting_efield .and. (.not. dipole_correction)) then
if (ionode) write(6,'(/,(a))')
. 'efield: SlabDipoleCorrection turned on automatically',
. 'efield: when an external electric field is applied.',
. 'efield: For backward compatibility, set if to .false.'
dipole_correction = .true.
endif
else
dipole_correction = .false.
end if
This code in m_efield.F always use True to overwrite the dipole_correction, no matter what user set, making it impossible to set it to false. |
|
| 2016-10-06 04:06:27 |
Chao Lian |
summary |
DipoleCorrection not working for slab |
DipoleCorrection is always true for slab |
|
| 2016-10-06 04:08:14 |
Chao Lian |
description |
if ( nbcell == 2 ) then
! Note that we enable the correction if there is an
! external field
dipole_correction = fdf_boolean("SlabDipoleCorrection",
& .false.)
if (acting_efield .and. (.not. dipole_correction)) then
if (ionode) write(6,'(/,(a))')
. 'efield: SlabDipoleCorrection turned on automatically',
. 'efield: when an external electric field is applied.',
. 'efield: For backward compatibility, set if to .false.'
dipole_correction = .true.
endif
else
dipole_correction = .false.
end if
This code in m_efield.F always use True to overwrite the dipole_correction, no matter what user set, making it impossible to set it to false. |
if ( nbcell == 2 ) then
! Note that we enable the correction if there is an
! external field
dipole_correction = fdf_boolean("SlabDipoleCorrection",
& .false.)
if (acting_efield .and. (.not. dipole_correction)) then
if (ionode) write(6,'(/,(a))')
. 'efield: SlabDipoleCorrection turned on automatically',
. 'efield: when an external electric field is applied.',
. 'efield: For backward compatibility, set if to .false.'
dipole_correction = .true.
endif
else
dipole_correction = .false.
end if
This code in m_efield.F always use True to overwrite the dipole_correction, no matter what user set, making it impossible to set it to false.
Version 4.1 |
|
| 2016-10-06 06:52:07 |
Nick Papior |
attachment added |
|
patch_1630827 https://bugs.launchpad.net/siesta/+bug/1630827/+attachment/4755715/+files/patch_1630827 |
|
| 2016-10-06 06:52:29 |
Nick Papior |
siesta: status |
New |
Triaged |
|
| 2016-10-06 06:52:34 |
Nick Papior |
siesta: importance |
Undecided |
Wishlist |
|
| 2016-10-06 07:11:15 |
Nick Papior |
nominated for series |
|
siesta/trunk |
|
| 2016-10-06 07:11:15 |
Nick Papior |
bug task added |
|
siesta/trunk |
|
| 2016-10-06 07:11:15 |
Nick Papior |
nominated for series |
|
siesta/4.0 |
|
| 2016-10-06 07:11:15 |
Nick Papior |
bug task added |
|
siesta/4.0 |
|
| 2016-10-06 07:11:15 |
Nick Papior |
nominated for series |
|
siesta/4.1 |
|
| 2016-10-06 07:11:15 |
Nick Papior |
bug task added |
|
siesta/4.1 |
|
| 2016-10-06 07:12:49 |
Nick Papior |
siesta/4.0: status |
New |
Triaged |
|
| 2016-10-06 07:12:51 |
Nick Papior |
siesta/4.1: status |
New |
Triaged |
|
| 2016-10-06 07:12:53 |
Nick Papior |
siesta/4.0: importance |
Undecided |
Wishlist |
|
| 2016-10-06 07:12:55 |
Nick Papior |
siesta/4.1: importance |
Undecided |
Wishlist |
|
| 2016-10-06 07:12:57 |
Nick Papior |
siesta/4.0: assignee |
|
Nick Papior (nickpapior) |
|
| 2016-10-06 07:12:59 |
Nick Papior |
siesta/4.1: assignee |
|
Nick Papior (nickpapior) |
|
| 2016-10-06 07:13:01 |
Nick Papior |
siesta/trunk: assignee |
|
Nick Papior (nickpapior) |
|
| 2016-10-06 07:25:39 |
Launchpad Janitor |
branch linked |
|
lp:siesta/4.0 |
|
| 2016-10-06 07:26:47 |
Launchpad Janitor |
branch linked |
|
lp:siesta/4.1 |
|
| 2016-10-06 07:35:52 |
Launchpad Janitor |
branch linked |
|
lp:siesta |
|
| 2016-10-06 07:44:17 |
Nick Papior |
siesta/4.0: status |
Triaged |
Fix Committed |
|
| 2016-10-06 07:44:19 |
Nick Papior |
siesta/4.1: status |
Triaged |
Fix Committed |
|
| 2016-10-06 07:44:21 |
Nick Papior |
siesta/trunk: status |
Triaged |
Fix Committed |
|
| 2016-10-13 08:55:16 |
Nick Papior |
siesta/4.1: milestone |
|
4.1-b2 |
|
| 2016-10-13 10:16:37 |
Nick Papior |
siesta/4.0: milestone |
|
4.0.1 |
|
| 2016-11-28 13:27:25 |
Nick Papior |
siesta/4.1: status |
Fix Committed |
Fix Released |
|
| 2016-11-28 13:28:48 |
Nick Papior |
bug task deleted |
siesta/trunk |
|
|
| 2017-02-20 14:40:04 |
Nick Papior |
siesta: milestone |
|
4.0.1 |
|
| 2017-07-05 07:04:44 |
Nick Papior |
siesta/4.0: status |
Fix Committed |
Fix Released |
|
| 2017-07-05 07:04:46 |
Nick Papior |
siesta: status |
Fix Committed |
Fix Released |
|
