document updated citation reminder
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@ -38,17 +38,18 @@ In addition there are DOIs for individual stable releases. Currently there are:
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Home page
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^^^^^^^^^
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The LAMMPS website at `https://lammps.sandia.gov/ <https://lammps.sandia.gov>`_ is the canonical
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location for information about LAMMPS and more detailed lists of publications
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using LAMMPS and contributing features.
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The LAMMPS website at `https://lammps.sandia.gov/
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<https://lammps.sandia.gov>`_ is the canonical location for information
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about LAMMPS and its features.
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Citing contributions
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^^^^^^^^^^^^^^^^^^^^
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LAMMPS has many features and uses previously published methods and
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algorithms or novel features. It also includes potential parameter
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filed for specific models. You can look up relevant publications either
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in the LAMMPS output to the screen, the ``log.cite`` file (which is
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populated with references to relevant papers through embedding them into
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the source code) and in the documentation of the :doc:`corresponding commands
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LAMMPS has many features and that use either previously published
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methods and algorithms or novel features. It also includes potential
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parameter filed for specific models. Where available, a reminder about
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references for optional features used in a specific run is printed to
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the screen and log file. Style and output location can be selected with
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the :ref:`-cite command-line switch <cite>`. Additional references are
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given in the documentation of the :doc:`corresponding commands
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<Commands_all>` or in the :doc:`Howto tutorials <Howto>`.
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@ -209,13 +209,13 @@ packages in the src directory for examples. If you are uncertain, please ask.
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A LaTeX citation is stored in a variable at the top of the file and a
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single line of code that references the variable is added to the
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constructor of the class. Whenever a user invokes your feature from
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their input script, this will cause LAMMPS to output the citation to a
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log.cite file and prompt the user to examine the file. Note that you
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should only use this for a paper you or your group authored.
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E.g. adding a cite in the code for a paper by Nose and Hoover if you
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write a fix that implements their integrator is not the intended
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usage. That kind of citation should just be in the doc page you
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provide.
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their input script, this will cause LAMMPS to output a reminder to
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cite that reference. Note that you should only use this for the most
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relevant paper for a feature and a publication that you or your group
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authored. E.g. adding a citation in the code for a paper by Nose and
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Hoover if you write a fix that implements their integrator is not the
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intended usage. That kind of citation should just be in the
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documentation page you provide describing your contribution.
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Finally, as a general rule-of-thumb, the more clear and
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self-explanatory you make your documentation and README files, and the
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@ -11,6 +11,7 @@ letter abbreviation can be used:
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* :ref:`-k or -kokkos <run-kokkos>`
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* :ref:`-l or -log <log>`
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* :ref:`-m or -mpicolor <mpicolor>`
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* :ref:`-c or -cite <cite>`
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* :ref:`-nc or -nocite <nocite>`
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* :ref:`-pk or -package <package>`
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* :ref:`-p or -partition <partition>`
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@ -220,14 +221,32 @@ links with from the lib/message directory. See the
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----------
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.. _cite:
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**-cite style or file name**
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Select how and where to output a reminder about citing contributions
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to the LAMMPS code that were used during the run. Available styles are
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"both", "none", "screen", or "log". Any flag will be considered a file
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name to write the citation info to. Default is the "log" style where
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there is a short summary in the screen output and detailed citations
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in BibTeX format in the logfile. The option "both" selects the detailed
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output for both, "none", the short output for both, and "screen" will
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write the detailed info to the screen and the short version to the log
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file. Any other option will be taken as a file name to which the detailed
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citation info is written and screen and log file output will be short
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(same as with "none").
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See the :doc:`citation page <Intro_citing>` for more details on
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how to correctly reference and cite LAMMPS.
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----------
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.. _nocite:
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**-nocite**
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Disable writing the log.cite file which is normally written to list
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references for specific cite-able features used during a LAMMPS run.
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See the `citation page <https://lammps.sandia.gov/cite.html>`_ for more
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details.
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Disable generating a citation reminder (see above) at all.
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----------
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@ -616,8 +616,8 @@ reset_mol_ids = yes, custom_charges = no, molecule = off
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.. _Gissinger:
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**(Gissinger)** Gissinger, Jensen and Wise, Polymer, 128, 211-217 (2017).
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**(Gissinger2017)** Gissinger, Jensen and Wise, Polymer, 128, 211-217 (2017).
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.. _Gissinger2020:
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**(Gissinger)** Gissinger, Jensen and Wise, Macromolecules, 53, 22, 9953–9961 (2020).
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**(Gissinger2020)** Gissinger, Jensen and Wise, Macromolecules, 53, 22, 9953-9961 (2020).
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@ -1286,7 +1286,7 @@ to cite the OpenKIM project :ref:`(Tadmor) <kim-mainpaper>`, KIM API
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in addition to the relevant scientific references for the IM.
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The citation format for an IM is displayed on its page on
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`OpenKIM <https://openkim.org>`_ along with the corresponding BibTex file,
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and is automatically added to the LAMMPS *log.cite* file.
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and is automatically added to the LAMMPS citation reminder.
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Citing the IM software (KIM infrastructure and specific PM or SM codes)
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used in the simulation gives credit to the researchers who developed them
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