git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5400 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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@ -63,6 +63,7 @@ own sub-directories with their own Makefiles.
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<LI><A HREF = "#msi">msi2lmp</A>
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<LI><A HREF = "#msi">msi2lmp</A>
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<LI><A HREF = "#pymol">pymol_asphere</A>
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<LI><A HREF = "#pymol">pymol_asphere</A>
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<LI><A HREF = "#pythontools">python</A>
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<LI><A HREF = "#pythontools">python</A>
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<LI><A HREF = "#reax">reax</A>
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<LI><A HREF = "#restart">restart2data</A>
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<LI><A HREF = "#restart">restart2data</A>
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<LI><A HREF = "#thermo_extract">thermo_extract</A>
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<LI><A HREF = "#thermo_extract">thermo_extract</A>
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<LI><A HREF = "#vim">vim</A>
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<LI><A HREF = "#vim">vim</A>
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@ -345,7 +346,7 @@ examples directory within pymol_asphere for more information.
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<H4><A NAME = "pythontools"></A>python tool
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<H4><A NAME = "pythontools"></A>python tool
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</H4>
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</H4>
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<P>The python sub-directory contains several Python scripts
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<P>The python sub-directory contains several Python scripts
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that perform common LAMMPS post-processing tasks, like
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that perform common LAMMPS post-processing tasks, such as:
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</P>
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</P>
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<UL><LI>extract thermodynamic info from a log file as columns of numbers
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<UL><LI>extract thermodynamic info from a log file as columns of numbers
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<LI>plot two columns of thermodynamic info from a log file using GnuPlot
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<LI>plot two columns of thermodynamic info from a log file using GnuPlot
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@ -358,6 +359,17 @@ README for more info on Pizza.py and how to use these scripts.
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</P>
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</P>
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<HR>
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<HR>
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<H4><A NAME = "reax"></A>reax tool
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</H4>
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<P>The reax sub-directory contains stand-alond codes that can
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post-process the output of the <A HREF = "fix_reax_bonds.html">fix reax/bonds</A>
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command from a LAMMPS simulation using <A HREF = "pair_reax.html">ReaxFF</A>. See
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the README.txt file for more info.
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</P>
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<P>These tools were written by Aidan Thompson at Sandia.
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</P>
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<HR>
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<H4><A NAME = "restart"></A>restart2data tool
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<H4><A NAME = "restart"></A>restart2data tool
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</H4>
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</H4>
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<P>The file restart2data.cpp converts a binary LAMMPS restart file into
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<P>The file restart2data.cpp converts a binary LAMMPS restart file into
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@ -59,6 +59,7 @@ own sub-directories with their own Makefiles.
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"msi2lmp"_#msi
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"msi2lmp"_#msi
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"pymol_asphere"_#pymol
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"pymol_asphere"_#pymol
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"python"_#pythontools
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"python"_#pythontools
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"reax"_#reax
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"restart2data"_#restart
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"restart2data"_#restart
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"thermo_extract"_#thermo_extract
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"thermo_extract"_#thermo_extract
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"vim"_#vim
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"vim"_#vim
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@ -341,7 +342,7 @@ This tool was written by Mike Brown at Sandia.
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python tool :h4,link(pythontools)
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python tool :h4,link(pythontools)
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The python sub-directory contains several Python scripts
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The python sub-directory contains several Python scripts
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that perform common LAMMPS post-processing tasks, like
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that perform common LAMMPS post-processing tasks, such as:
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extract thermodynamic info from a log file as columns of numbers
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extract thermodynamic info from a log file as columns of numbers
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plot two columns of thermodynamic info from a log file using GnuPlot
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plot two columns of thermodynamic info from a log file using GnuPlot
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@ -354,6 +355,17 @@ README for more info on Pizza.py and how to use these scripts.
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:line
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:line
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reax tool :h4,link(reax)
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The reax sub-directory contains stand-alond codes that can
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post-process the output of the "fix reax/bonds"_fix_reax_bonds.html
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command from a LAMMPS simulation using "ReaxFF"_pair_reax.html. See
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the README.txt file for more info.
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These tools were written by Aidan Thompson at Sandia.
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:line
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restart2data tool :h4,link(restart)
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restart2data tool :h4,link(restart)
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The file restart2data.cpp converts a binary LAMMPS restart file into
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The file restart2data.cpp converts a binary LAMMPS restart file into
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