Add openkim-models install instructions

This commit is contained in:
Ryan S. Elliott
2020-02-10 21:29:21 -06:00
parent f0935feabe
commit cf67c16fcb

View File

@ -132,11 +132,21 @@ mirrors. The "module load" command is needed once per (shell) session
or shell terminal instance, unless it is automatically loaded from the or shell terminal instance, unless it is automatically loaded from the
shell profile. shell profile.
The LAMMPS binary is built with the :ref:`KIM package <kim>` which
results in the above command also installing the `kim-api` binaries when LAMMPS
is installed. In order to use potentials from `openkim.org <openkim_>`_, you
can install the `openkim-models` package
.. parsed-literal::
dnf install openkim-models
Please use "lmp -help" to see which compilation options, packages, Please use "lmp -help" to see which compilation options, packages,
and styles are included in the binary. and styles are included in the binary.
Thanks to Christoph Junghans (LANL) for making LAMMPS available in Fedora. Thanks to Christoph Junghans (LANL) for making LAMMPS available in Fedora.
.. _openkim: https://openkim.org
---------- ----------
@ -146,7 +156,7 @@ Thanks to Christoph Junghans (LANL) for making LAMMPS available in Fedora.
Pre-built EPEL Linux executable Pre-built EPEL Linux executable
------------------------------------------ ------------------------------------------
Pre-built LAMMPS packages for stable releases are available Pre-built LAMMPS (and KIM) packages for stable releases are available
in the `Extra Packages for Enterprise Linux (EPEL) repository <https://fedoraproject.org/wiki/EPEL>`_ in the `Extra Packages for Enterprise Linux (EPEL) repository <https://fedoraproject.org/wiki/EPEL>`_
for use with Red Hat Enterprise Linux (RHEL) or CentOS version 7.x for use with Red Hat Enterprise Linux (RHEL) or CentOS version 7.x
and compatible Linux distributions. Names of packages, executable, and compatible Linux distributions. Names of packages, executable,
@ -187,6 +197,15 @@ is *lmp*\ . Thus to run an input in parallel on 2 CPUs you would do:
Please use "lmp -help" to see which compilation options, packages, Please use "lmp -help" to see which compilation options, packages,
and styles are included in the binary. and styles are included in the binary.
The LAMMPS binary is built with the :ref:`KIM package <kim>` which
results in the above command also installing the `kim-api` binaries when LAMMPS
is installed. In order to use potentials from `openkim.org <openkim_>`_, you
can install the `openkim-models` package
.. parsed-literal::
zypper install openkim-models
Thanks to Christoph Junghans (LANL) for making LAMMPS available in OpenSuse. Thanks to Christoph Junghans (LANL) for making LAMMPS available in OpenSuse.