one more pass at revising the introductory pages of the LAMMPS manual
This commit is contained in:
@ -29,25 +29,24 @@ versions can be downloaded as source code from the `LAMMPS website
|
||||
|
||||
LAMMPS is designed to be easy to modify or extend with new capabilities,
|
||||
such as new force fields, atom types, boundary conditions, or
|
||||
diagnostics. See the :doc:`Modify <Modify>` page for more details.
|
||||
diagnostics. See the :doc:`Modify` section of for more details.
|
||||
|
||||
In the most general sense, LAMMPS integrates Newton's equations of
|
||||
motion for a collection of interacting particles. A single particle
|
||||
can be an atom or molecule or electron, a coarse-grained cluster of
|
||||
atoms, or a mesoscopic or macroscopic clump of material. The
|
||||
interaction models that LAMMPS includes are mostly short-range in
|
||||
nature; some long-range models are included as well.
|
||||
motion for a collection of interacting particles. A single particle can
|
||||
be an atom or molecule or electron, a coarse-grained cluster of atoms,
|
||||
or a mesoscopic or macroscopic clump of material. The interaction
|
||||
models that LAMMPS includes are mostly short-ranged in nature; some
|
||||
long-range models are included as well.
|
||||
|
||||
LAMMPS uses neighbor lists to keep track of nearby particles. The
|
||||
lists are optimized for systems with particles that are repulsive at
|
||||
short distances, so that the local density of particles never becomes
|
||||
too large. This is in contrast to methods used for modeling plasma
|
||||
or gravitational bodies (e.g. galaxy formation).
|
||||
LAMMPS uses neighbor lists to keep track of nearby particles. The lists
|
||||
are optimized for systems with particles that are repulsive at short
|
||||
distances, so that the local density of particles never becomes too
|
||||
large. This is in contrast to methods used for modeling plasma or
|
||||
gravitational bodies (e.g. galaxy formation).
|
||||
|
||||
On parallel machines, LAMMPS uses spatial-decomposition techniques with
|
||||
MPI parallelization to partition the simulation domain into small
|
||||
sub-domains of equal computational cost, one of which is assigned to
|
||||
each processor. Processors communicate and store "ghost" atom
|
||||
information for atoms that border their sub-domain. Multi-threading
|
||||
parallelization and GPU acceleration with with particle-decomposition
|
||||
can be used in addition.
|
||||
MPI parallelization to partition the simulation domain into sub-domains
|
||||
of equal computational cost, one of which is assigned to each processor.
|
||||
Processors communicate and store "ghost" atom information for atoms that
|
||||
border their sub-domain. Multi-threading parallelization and GPU
|
||||
acceleration with with particle-decomposition can be used in addition.
|
||||
|
||||
@ -23,27 +23,33 @@ coordinated.
|
||||
----------
|
||||
|
||||
The content for this manual is part of the LAMMPS distribution. The
|
||||
online version always corresponds to the latest development version.
|
||||
If needed, you can download or build a local copy of the manual as
|
||||
HTML pages or a PDF file by following the steps on the
|
||||
:doc:`Build_manual` page. If you have difficulties viewing the pages
|
||||
please :ref:`see this note <webbrowser>`.
|
||||
online version always corresponds to the latest feature release version.
|
||||
If needed, you can build a local copy of the manual as HTML pages or a
|
||||
PDF file by following the steps on the :doc:`Build_manual` page. If you
|
||||
have difficulties viewing the pages please :ref:`see this note
|
||||
<webbrowser>`.
|
||||
|
||||
-----------
|
||||
|
||||
The manual is organized in three parts:
|
||||
1) the :ref:`User Guide <user_documentation>` for how to install
|
||||
and use LAMMPS, 2) the :ref:`Programmer Guide <programmer_documentation>`
|
||||
for how to write programs using the LAMMPS library from different
|
||||
programming languages and how to modify and extend LAMMPS, and 3) the
|
||||
:ref:`Command Reference <command_reference>` which includes detailed
|
||||
descriptions of all commands included in the LAMMPS code.
|
||||
|
||||
1. the :ref:`User Guide <user_documentation>` with information about how
|
||||
to obtain, configure, compile, install, and use LAMMPS,
|
||||
2. the :ref:`Programmer Guide <programmer_documentation>` with
|
||||
information about how to use the LAMMPS library interface from
|
||||
different programming languages, how to modify and extend LAMMPS,
|
||||
the program design, internal programming interfaces, and code
|
||||
design conventions,
|
||||
3. the :ref:`Command Reference <command_reference>` with detailed
|
||||
descriptions of all input script commands available in LAMMPS.
|
||||
|
||||
----------
|
||||
|
||||
.. only:: html
|
||||
|
||||
Once you are familiar with LAMMPS, you may want to bookmark
|
||||
:doc:`this page <Commands_all>` since it gives quick access to
|
||||
the documentation for all LAMMPS commands.
|
||||
:doc:`this page <Commands_all>`, since it gives quick access to
|
||||
tables with links to the documentation for all LAMMPS commands.
|
||||
|
||||
.. _lws: https://www.lammps.org
|
||||
|
||||
|
||||
@ -6,38 +6,49 @@ The LAMMPS "version" is the date when it was released, such as 1 May
|
||||
correctly and reliably at all times. You can follow its development
|
||||
in a public `git repository on GitHub <https://github.com/lammps/lammps>`_.
|
||||
|
||||
Whenever we fix a bug or update or add a feature, it will be merged into
|
||||
the *develop* branch of the git repository. When a sufficient number of
|
||||
changes have accumulated *and* the software passes a set of automated
|
||||
tests, we release it in the next *patch* release, which are made every
|
||||
few weeks. The *release* branch of the git repository is updated with
|
||||
every such release. Info on patch releases are on `this website page
|
||||
<https://www.lammps.org/bug.html>`_.
|
||||
Modifications of the LAMMPS source code - like bug fixes, code
|
||||
refactors, updates to existing features, or addition of new features -
|
||||
are organized into pull requests, and will be merged into the *develop*
|
||||
branch of the git repository when they pass automated testing and code
|
||||
review by the LAMMPS developers. When a sufficient number of changes
|
||||
have accumulated *and* the software passes a set of automated tests, we
|
||||
release it as a *feature release* (or patch release), which are
|
||||
currently made every 4-8 weeks. The *release* branch of the git
|
||||
repository is updated with every such release. A summary of the most
|
||||
important changes of the patch releases are on `this website page
|
||||
<https://www.lammps.org/bug.html>`_. More detailed release notes are
|
||||
`available on GitHub <https://github.com/lammps/lammps/releases/>`_.
|
||||
|
||||
Once or twice a year, we have a period where we apply only bug fixes and
|
||||
small, non-intrusive changes to the *develop* branch and the code is at
|
||||
the same time subjected to more detailed and thorough manual testing
|
||||
than the default automated testing. The latest patch release after such
|
||||
a period is then also labeled as a *stable* version and the *stable*
|
||||
branch is updated with it. Between stable releases we occasionally
|
||||
release some updates to the stable release containing only bug fixes and
|
||||
updates back-ported from *develop* but no new features and update the
|
||||
*stable* branch accordingly.
|
||||
Once or twice a year, we have a "stabilization period" where we apply
|
||||
only bug fixes and small, non-intrusive changes to the *develop*
|
||||
branch. At the same time the code is subjected to more detailed and
|
||||
thorough manual testing than the default automated testing. Also
|
||||
several variants of static code analysis are run to improve the overall
|
||||
code quality, consistency, and compliance with programming standards,
|
||||
best practices and style conventions.
|
||||
|
||||
The latest patch release after such a period is then also labeled as a
|
||||
*stable* version and the *stable* branch is updated with it. Between
|
||||
stable releases we occasionally release updates to the stable release
|
||||
containing only bug fixes and updates back-ported from the *develop*
|
||||
branch and update the *stable* branch accordingly.
|
||||
|
||||
Each version of LAMMPS contains all the documented features up to and
|
||||
including its version date. For recently added features we add markers
|
||||
to the documentation at which specific LAMMPS version a feature was
|
||||
added or significantly changed.
|
||||
to the documentation at which specific LAMMPS version a feature or
|
||||
keyword was added or significantly changed.
|
||||
|
||||
The version date is printed to the screen and logfile every time you
|
||||
run LAMMPS. It is also in the file src/version.h and in the LAMMPS
|
||||
The version date is printed to the screen and logfile every time you run
|
||||
LAMMPS. It is also in the file src/version.h and in the LAMMPS
|
||||
directory name created when you unpack a tarball. And it is on the
|
||||
first page of the :doc:`manual <Manual>`.
|
||||
|
||||
* If you browse the HTML pages on the LAMMPS WWW site, they will by
|
||||
default describe the most current patch release version of LAMMPS.
|
||||
In the navigation bar on the bottom left, there is the option to
|
||||
view instead the documentation for the most recent *stable* version
|
||||
or the latest version from the current development branch.
|
||||
* If you browse the HTML pages included in your tarball, they
|
||||
describe the version you have, which may be older.
|
||||
* If you browse the HTML pages of the online version of the LAMMPS
|
||||
manual, they will by default describe the most current patch release
|
||||
version of LAMMPS. In the navigation bar on the bottom left, there is
|
||||
the option to view instead the documentation for the most recent
|
||||
*stable* version or the documentation corresponding to the state of
|
||||
the development branch.
|
||||
* If you browse the HTML pages included in your downloaded tarball, they
|
||||
describe the version you have, which may be older than the online
|
||||
version.
|
||||
|
||||
@ -3009,6 +3009,7 @@ recursing
|
||||
Ree
|
||||
refactored
|
||||
refactoring
|
||||
refactors
|
||||
reflectionstyle
|
||||
Reinders
|
||||
reinit
|
||||
|
||||
Reference in New Issue
Block a user