ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

update release date to 21 November 2023

Browse Source
This commit is contained in:
Axel Kohlmeyer
2023-11-19 05:40:05 -05:00
parent d60fb7067a
commit 11305107d9
12 changed files with 17 additions and 17 deletions
Download Patch File Download Diff File Expand all files Collapse all files

4
doc/lammps.1
View File

@ -1,7 +1,7 @@
.TH LAMMPS "1" "17 November 2023" "2023-11-17" .TH LAMMPS "1" "21 November 2023" "2023-11-21"
.SH NAME .SH NAME
.B LAMMPS .B LAMMPS
\- Molecular Dynamics Simulator. Version 17 November 2023 \- Molecular Dynamics Simulator. Version 21 November 2023
.SH SYNOPSIS .SH SYNOPSIS
.B lmp .B lmp

4
doc/src/Commands_removed.rst
View File

@ -88,7 +88,7 @@ The same functionality is available through
MPIIO package MPIIO package
------------- -------------
.. deprecated:: 17Nov2023 .. deprecated:: 21Nov2023
The MPIIO package has been removed from LAMMPS since it was unmaintained The MPIIO package has been removed from LAMMPS since it was unmaintained
for many years and thus not updated to incorporate required changes that for many years and thus not updated to incorporate required changes that
@ -107,7 +107,7 @@ see :doc:`restart <restart>`, :doc:`read_restart <read_restart>`,
MSCG package MSCG package
------------ ------------
.. deprecated:: 17Nov2023 .. deprecated:: 21Nov2023
The MSCG package has been removed from LAMMPS since it was unmaintained The MSCG package has been removed from LAMMPS since it was unmaintained
for many years and instead superseded by the `OpenMSCG software for many years and instead superseded by the `OpenMSCG software

2
doc/src/compute_composition_atom.rst
View File

@ -36,7 +36,7 @@ Examples
Description Description
""""""""""" """""""""""
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
Define a computation that calculates a local composition vector for each Define a computation that calculates a local composition vector for each
atom. For a central atom with :math:`M` neighbors within the neighbor cutoff sphere, atom. For a central atom with :math:`M` neighbors within the neighbor cutoff sphere,

2
doc/src/compute_property_grid.rst
View File

@ -61,7 +61,7 @@ varying fastest, then Y, then Z slowest. For 2d grids (in 2d
simulations), the grid IDs range from 1 to Nx*Ny, with X varying simulations), the grid IDs range from 1 to Nx*Ny, with X varying
fastest and Y slowest. fastest and Y slowest.
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
The *proc* attribute is the ID of the processor which owns the grid The *proc* attribute is the ID of the processor which owns the grid
cell. Processor IDs range from 0 to Nprocs - 1, where Nprocs is the cell. Processor IDs range from 0 to Nprocs - 1, where Nprocs is the

2
doc/src/compute_reduce.rst
View File

@ -201,7 +201,7 @@ information in this context, the *replace* keywords will extract the
atom IDs for the two atoms in the bond of maximum stretch. These atom atom IDs for the two atoms in the bond of maximum stretch. These atom
IDs and the bond stretch will be printed with thermodynamic output. IDs and the bond stretch will be printed with thermodynamic output.
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
The *inputs* keyword allows selection of whether all the inputs are The *inputs* keyword allows selection of whether all the inputs are
per-atom or local quantities. As noted above, all the inputs must be per-atom or local quantities. As noted above, all the inputs must be

2
doc/src/compute_voronoi_atom.rst
View File

@ -190,7 +190,7 @@ Voro++ software in the src/VORONOI/README file.
Output info Output info
""""""""""" """""""""""
.. deprecated:: 17Nov2023 .. deprecated:: 21Nov2023
The *peratom* keyword was removed as it is no longer required. The *peratom* keyword was removed as it is no longer required.

2
doc/src/dump.rst
View File

@ -613,7 +613,7 @@ when running on large numbers of processors.
Note that using the "\*" and "%" characters together can produce a Note that using the "\*" and "%" characters together can produce a
large number of small dump files! large number of small dump files!
.. deprecated:: 17Nov2023 .. deprecated:: 21Nov2023
The MPIIO package and the the corresponding "/mpiio" dump styles, except The MPIIO package and the the corresponding "/mpiio" dump styles, except
for the unrelated "netcdf/mpiio" style were removed from LAMMPS. for the unrelated "netcdf/mpiio" style were removed from LAMMPS.

2
doc/src/dump_image.rst
View File

@ -599,7 +599,7 @@ image will appear. The *sfactor* value must be a value 0.0 <=
*sfactor* <= 1.0, where *sfactor* = 1 is a highly reflective surface *sfactor* <= 1.0, where *sfactor* = 1 is a highly reflective surface
and *sfactor* = 0 is a rough non-shiny surface. and *sfactor* = 0 is a rough non-shiny surface.
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
The *fsaa* keyword can be used with the dump image command to improve The *fsaa* keyword can be used with the dump image command to improve
the image quality by enabling full scene anti-aliasing. Internally the the image quality by enabling full scene anti-aliasing. Internally the

2
doc/src/fix_deposit.rst
View File

@ -220,7 +220,7 @@ rotated configuration of the molecule.
existing particle. LAMMPS will issue a warning if R is smaller than existing particle. LAMMPS will issue a warning if R is smaller than
this value, based on the radii of existing and inserted particles. this value, based on the radii of existing and inserted particles.
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
The *var* and *set* keywords can be used together to provide a criterion The *var* and *set* keywords can be used together to provide a criterion
for accepting or rejecting the addition of an individual atom, based on its for accepting or rejecting the addition of an individual atom, based on its

2
doc/src/fix_pimd.rst
View File

@ -149,7 +149,7 @@ normal-mode PIMD. A value of *cmd* is for centroid molecular dynamics
only the k > 0 modes are thermostatted, not the centroid degrees of only the k > 0 modes are thermostatted, not the centroid degrees of
freedom. freedom.
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
Mode *pimd* added to fix pimd/langevin. Mode *pimd* added to fix pimd/langevin.

8
src/library.cpp
View File

@ -617,7 +617,7 @@ combined by removing the '&' and the following newline character. After
this processing the string is handed to LAMMPS for parsing and this processing the string is handed to LAMMPS for parsing and
executing. executing.
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
The command is now able to process long strings with triple quotes and The command is now able to process long strings with triple quotes and
loops using :doc:`jump SELF \<label\> <jump>`. loops using :doc:`jump SELF \<label\> <jump>`.
@ -2484,7 +2484,7 @@ int lammps_set_variable(void *handle, char *name, char *str)
* *
\verbatim embed:rst \verbatim embed:rst
.. versionadded:: 17Nov2023 .. versionadded:: 21Nov2023
This function copies a string with human readable information about This function copies a string with human readable information about
a defined variable: name, style, current value(s) into the provided a defined variable: name, style, current value(s) into the provided
@ -5581,7 +5581,7 @@ int lammps_config_has_ffmpeg_support() {
* *
\verbatim embed:rst \verbatim embed:rst
.. deprecated:: 17Nov2023 .. deprecated:: 21Nov2023
LAMMPS has now exceptions always enabled, so this function LAMMPS has now exceptions always enabled, so this function
will now always return 1 and can be removed from applications will now always return 1 and can be removed from applications
@ -6658,7 +6658,7 @@ the failing MPI ranks to send messages.
instance, but instead would check the global error buffer of the instance, but instead would check the global error buffer of the
library interface. library interface.
.. versionchanged: 17Nov2023 .. versionchanged: 21Nov2023
The *buffer* pointer may be ``NULL``. This will clear any error The *buffer* pointer may be ``NULL``. This will clear any error
status without copying the error message. status without copying the error message.

2
src/version.h
View File

@ -1 +1 @@
#define LAMMPS_VERSION "17 Nov 2023" #define LAMMPS_VERSION "21 Nov 2023"