Merge pull request lammps#4071 from akohlmey/next_release

Update version tags and strings for the next feature release
agiliopadua · Feb 7, 2024 · b5a1c1a · b5a1c1a
2 parents c81d3ec + 1eeb7ab
commit b5a1c1a
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diff --git a/doc/lammps.1 b/doc/lammps.1
@@ -1,7 +1,7 @@
-.TH LAMMPS "1" "21 November 2023" "2023-11-21"
+.TH LAMMPS "1" "7 February 2024" "2024-02-07"
 .SH NAME
 .B LAMMPS
-\- Molecular Dynamics Simulator.  Version 21 November 2023
+\- Molecular Dynamics Simulator.  Version 7 February 2024
 
 .SH SYNOPSIS
 .B lmp

diff --git a/doc/src/Build_settings.rst b/doc/src/Build_settings.rst
@@ -44,7 +44,7 @@ require use of an FFT library to compute 1d FFTs.  The KISS FFT
 library is included with LAMMPS, but other libraries can be faster.
 LAMMPS can use them if they are available on your system.
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 Alternatively, LAMMPS can use the `heFFTe
 <https://icl-utk-edu.github.io/heffte/>`_ library for the MPI

diff --git a/doc/src/Commands_removed.rst b/doc/src/Commands_removed.rst
@@ -129,7 +129,7 @@ USER-REAXC.
 USER-REAXC package
 ------------------
 
-.. deprecated:: TBD
+.. deprecated:: 7Feb2024
 
 The USER-REAXC package has been renamed to :ref:`REAXFF <PKG-REAXFF>`.
 In the process also the pair style and related fixes were renamed to use

diff --git a/doc/src/Fortran.rst b/doc/src/Fortran.rst
@@ -1402,7 +1402,7 @@ Procedures Bound to the :f:type:`lammps` Derived Type
 
    Set the value of a string-style variable.
 
-   .. deprecated:: TBD
+   .. deprecated:: 7Feb2024
 
    This function assigns a new value from the string *str* to the string-style
    variable *name*\ . If *name* does not exist or is not a string-style
@@ -1423,7 +1423,7 @@ Procedures Bound to the :f:type:`lammps` Derived Type
 
    Set the value of a string-style variable.
 
-   .. versionadded:: TBD
+   .. versionadded:: 7Feb2024
 
    This function assigns a new value from the string *str* to the string-style
    variable *name*\ . If *name* does not exist or is not a string-style
@@ -1439,7 +1439,7 @@ Procedures Bound to the :f:type:`lammps` Derived Type
 
    Set the value of a internal-style variable.
 
-   .. versionadded:: TBD
+   .. versionadded:: 7Feb2024
 
    This function assigns a new value from the floating-point number *val* to
    the internal-style variable *name*\ . If *name* does not exist or is not

diff --git a/doc/src/angle_lepton.rst b/doc/src/angle_lepton.rst
@@ -51,7 +51,7 @@ angle coefficient.  For example `"200.0*theta^2"` represents a
 
    U_{angle,i} = K (\theta_i - \theta_0)^2 = K \theta^2 \qquad \theta = \theta_i - \theta_0
 
-.. versionchanged:: TBD
+.. versionchanged:: 7Feb2024
 
 By default the potential energy U is shifted so that the value U is 0.0
 for $theta = theta_0$.  This is equivalent to using the optional keyword

diff --git a/doc/src/bond_lepton.rst b/doc/src/bond_lepton.rst
@@ -50,7 +50,7 @@ constant *K* of 200.0 energy units:
 
    U_{bond,i} = K (r_i - r_0)^2 = K r^2 \qquad r = r_i - r_0
 
-.. versionchanged:: TBD
+.. versionchanged:: 7Feb2024
 
 By default the potential energy U is shifted so that he value U is 0.0
 for $r = r_0$.  This is equivalent to using the optional keyword

diff --git a/doc/src/compute_pace.rst b/doc/src/compute_pace.rst
@@ -36,7 +36,7 @@ Examples
 Description
 """""""""""
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 This compute calculates a set of quantities related to the atomic
 cluster expansion (ACE) descriptors of the atoms in a group.  ACE

diff --git a/doc/src/compute_rattlers_atom.rst b/doc/src/compute_rattlers_atom.rst
@@ -32,7 +32,7 @@ Examples
 Description
 """""""""""
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 Define a compute that identifies rattlers in a system. Rattlers are often
 identified in granular or glassy packings as under-coordinated atoms that

diff --git a/doc/src/compute_reaxff_atom.rst b/doc/src/compute_reaxff_atom.rst
@@ -40,7 +40,7 @@ Examples
 Description
 """""""""""
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 Define a computation that extracts bond information computed by the ReaxFF
 potential specified by :doc:`pair_style reaxff <pair_reaxff>`.

diff --git a/doc/src/compute_slcsa_atom.rst b/doc/src/compute_slcsa_atom.rst
@@ -32,7 +32,7 @@ Examples
 Description
 """""""""""
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 Define a computation that performs the Supervised Learning Crystal
 Structure Analysis (SL-CSA) from :ref:`(Lafourcade) <Lafourcade2023_1>`

diff --git a/doc/src/fix_nonaffine_displacement.rst b/doc/src/fix_nonaffine_displacement.rst
@@ -44,7 +44,7 @@ Examples
 Description
 """""""""""
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 This fix computes different metrics of the nonaffine displacement of
 particles. The first metric, *d2min* calculates the :math:`D^2_\mathrm{min}`

diff --git a/doc/src/info.rst b/doc/src/info.rst
@@ -92,7 +92,7 @@ The *accelerator* category prints out information about compile time
 settings of included accelerator support for the GPU, KOKKOS, INTEL,
 and OPENMP packages.
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 The *fft* category prints out information about the included 3d-FFT
 support.  This lists the 3d-FFT engine, FFT precision, FFT library

diff --git a/doc/src/molecule.rst b/doc/src/molecule.rst
@@ -376,7 +376,7 @@ not listed, the default diameter of each atom in the molecule is 1.0.
 
 ----------
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 *Dipoles* section:
 

diff --git a/doc/src/variable.rst b/doc/src/variable.rst
@@ -706,7 +706,7 @@ library.  Ceil() is the smallest integer not less than its argument.
 Floor() if the largest integer not greater than its argument.  Round()
 is the nearest integer to its argument.
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 The ternary(x,y,z) function is the equivalent of the ternary operator
 (? and :) in C or C++.  It takes 3 arguments.  The first argument is a
@@ -1155,7 +1155,7 @@ variable by using the :doc:`compute property/atom
 Custom atom properties
 ----------------------
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 Custom atom properties refer to per-atom integer and floating point
 vectors or arrays that have been added via the :doc:`fix property/atom

diff --git a/python/lammps/core.py b/python/lammps/core.py
@@ -1254,7 +1254,7 @@ def flush_buffers(self):
   def set_variable(self,name,value):
     """Set a new value for a LAMMPS string style variable
 
-    .. deprecated:: TBD
+    .. deprecated:: 7Feb2024
 
     This is a wrapper around the :cpp:func:`lammps_set_variable`
     function of the C-library interface.
@@ -1278,7 +1278,7 @@ def set_variable(self,name,value):
   def set_string_variable(self,name,value):
     """Set a new value for a LAMMPS string style variable
 
-    .. versionadded:: TBD
+    .. versionadded:: 7Feb2024
 
     This is a wrapper around the :cpp:func:`lammps_set_string_variable`
     function of the C-library interface.
@@ -1302,7 +1302,7 @@ def set_string_variable(self,name,value):
   def set_internal_variable(self,name,value):
     """Set a new value for a LAMMPS internal style variable
 
-    .. versionadded:: TBD
+    .. versionadded:: 7Feb2024
 
     This is a wrapper around the :cpp:func:`lammps_set_internal_variable`
     function of the C-library interface.

diff --git a/src/library.cpp b/src/library.cpp
@@ -2455,7 +2455,7 @@ static int set_variable_deprecated_flag = 1;
 /** Set the value of a string-style variable.
 \verbatim embed:rst
 
-.. deprecated:: TBD
+.. deprecated:: 7Feb2024
 
 This function assigns a new value from the string str to the
 string-style variable *name*.  This is a way to directly change the
@@ -2493,7 +2493,7 @@ int lammps_set_variable(void *handle, const char *name, const char *str)
 /** Set the value of a string-style variable.
 \verbatim embed:rst
 
-.. versionadded:: TBD
+.. versionadded:: 7Feb2024
 
 This function assigns a new value from the string str to the
 string-style variable *name*.  This is a way to directly change the
@@ -2531,6 +2531,8 @@ int lammps_set_string_variable(void *handle, const char *name, const char *str)
  *
 \verbatim embed:rst
 
+.. versionadded:: 7Feb2024
+
 This function assigns a new value from the floating point number *value*
 to the internal-style variable *name*.  This is a way to directly change
 the numerical value of such a LAMMPS variable that was previous defined

diff --git a/src/version.h b/src/version.h
@@ -1,2 +1 @@
-#define LAMMPS_VERSION "21 Nov 2023"
-#define LAMMPS_UPDATE "Development"
+#define LAMMPS_VERSION "7 Feb 2024"