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Merge pull request #3706 from akohlmey/next_patch_release

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Update version strings for feature release
This commit is contained in:
Axel Kohlmeyer
2023-03-28 20:57:19 -04:00
committed by GitHub
parent bb01b849a9 0d145f317f
commit ff96eb2e84
15 changed files with 17 additions and 17 deletions
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4
doc/lammps.1
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@ -1,7 +1,7 @@
.TH LAMMPS "1" "8 February 2023" "2023-02-08"
.TH LAMMPS "1" "28 March 2023" "2023-03-28"
.SH NAME
.B LAMMPS
\- Molecular Dynamics Simulator. Version 8 February 2023
\- Molecular Dynamics Simulator. Version 28 March 2023
.SH SYNOPSIS
.B lmp

2
doc/src/Developer_updating.rst
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@ -389,7 +389,7 @@ This change is **required** or else the code will not compile.
Rename of fix STORE/PERATOM to fix STORE/ATOM and change of arguments
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
.. versionchanged:: TBD
.. versionchanged:: 28Mar2023
The available functionality of the internal fix to store per-atom
properties was expanded to enable storing data with ghost atoms and to

2
doc/src/bond_bpm_rotational.rst
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@ -143,7 +143,7 @@ the *overlay/pair* keyword. These settings require specific
restrictions. Further details can be found in the `:doc: how to
<Howto_BPM>` page on BPMs.
.. versionadded:: TBD
.. versionadded:: 28Mar2023
If the *break/no* keyword is used, then LAMMPS assumes bonds should not break
during a simulation run. This will prevent some unnecessary calculation.

2
doc/src/bond_bpm_spring.rst
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@ -109,7 +109,7 @@ the *overlay/pair* keyword. These settings require specific
restrictions. Further details can be found in the `:doc: how to
<Howto_BPM>` page on BPMs.
.. versionadded:: TBD
.. versionadded:: 28Mar2023
If the *break/no* keyword is used, then LAMMPS assumes bonds should not break
during a simulation run. This will prevent some unnecessary calculation.

2
doc/src/bond_harmonic_restrain.rst
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@ -21,7 +21,7 @@ Examples
Description
"""""""""""
.. versionadded:: TBD
.. versionadded:: 28Mar2023
The *harmonic/restrain* bond style uses the potential

2
doc/src/compute_dipole.rst
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@ -42,7 +42,7 @@ geometric center times the net charge from the computed dipole
vector. Both per-atom charges and per-atom dipole moments, if present,
contribute to the computed dipole.
.. versionadded:: TBD
.. versionadded:: 28Mar2023
Compute *dipole/tip4p* includes adjustments for the charge carrying
point M in molecules with TIP4P water geometry. The corresponding

2
doc/src/compute_dipole_chunk.rst
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@ -51,7 +51,7 @@ center times the net charge from the computed dipole vector. Both
per-atom charges and per-atom dipole moments, if present, contribute to
the computed dipole.
.. versionadded:: TBD
.. versionadded:: 28Mar2023
Compute *dipole/tip4p/chunk* includes adjustments for the charge
carrying point M in molecules with TIP4P water geometry. The

2
doc/src/compute_pressure_alchemy.rst
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@ -26,7 +26,7 @@ Examples
Description
"""""""""""
.. versionadded:: TBD
.. versionadded:: 28Mar2023
Define a compute style that makes the "mixed" system pressure available
for a system that uses the :doc:`fix alchemy <fix_alchemy>` command to

2
doc/src/fix_alchemy.rst
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@ -24,7 +24,7 @@ Examples
Description
"""""""""""
.. versionadded:: TBD
.. versionadded:: 28Mar2023
This fix command enables an "alchemical transformation" to be performed
between two systems, whereby one system slowly transforms into the other

2
doc/src/fix_efield.rst
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@ -45,7 +45,7 @@ external electric field being applied to the system. If the system
contains point-dipoles, also add a torque on the dipoles due to the
external electric field.
.. versionadded:: TBD
.. versionadded:: 28Mar2023
When the *efield/tip4p* style is used, the E-field will be applied to
the position of the virtual charge site M of a TIP4P molecule instead of

2
doc/src/fix_mdi_qmmm.rst
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@ -39,7 +39,7 @@ Examples
Description
"""""""""""
.. versionadded:: TBD
.. versionadded:: 28Mar2023
This command enables LAMMPS to act as a client with another server code
to perform a coupled QM/MM (quantum-mechanics/molecular-mechanics)

2
doc/src/fix_pimd.rst
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@ -33,7 +33,7 @@ Examples
Description
"""""""""""
.. versionchanged:: TBD
.. versionchanged:: 28Mar2023
Fix pimd was renamed to fix pimd/nvt.

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doc/src/fix_wall.rst
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@ -194,7 +194,7 @@ For style *wall/morse*, the energy E is given by a Morse potential:
E = D_0 \left[ e^{- 2 \alpha (r - r_0)} - 2 e^{- \alpha (r - r_0)} \right]
\qquad r < r_c
.. versionadded:: TBD
.. versionadded:: 28Mar2023
For style *wall/lepton*, the energy E is provided as an Lepton
expression string using "r" as the distance variable. The `Lepton
@ -215,7 +215,7 @@ spring as in fix *wall/harmonic* with a force constant *K* (same as
:math:`\epsilon` above) of 100 energy units. More details on the Lepton
expression strings are given below.
.. versionadded:: TBD
.. versionadded:: 28Mar2023
For style *wall/table*, the energy E and forces are determined from
interpolation tables listed in one or more files as a function of

2
doc/src/pair_gauss.rst
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@ -170,7 +170,7 @@ The *gauss* and *gauss/cut* styles are part of the EXTRA-PAIR package.
They are only enabled if LAMMPS is build with that package. See the
:doc:`Build package <Build_package>` page for more info.
.. versionchanged:: TBD
.. versionchanged:: 28Mar2023
Prior to this version, the *gauss* pair style did not apply
:doc:`special_bonds <special_bonds>` factors.

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src/version.h
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@ -1 +1 @@
#define LAMMPS_VERSION "8 Feb 2023"
#define LAMMPS_VERSION "28 Mar 2023"