Loading doc/pair_kim.html +6 −2 Original line number Diff line number Diff line Loading @@ -13,11 +13,11 @@ </H3> <P><B>Syntax:</B> </P> <PRE>pair_style kim virialmode model print-flag <PRE>pair_style kim virialmode model printflag </PRE> <UL><LI>virialmode = KIMvirial or LAMMPSvirial <LI>model = name of KIM model (potential) <LI>print-flag = 0/1 do/do not print kim descriptor file; default: 0 <LI>printflag = 1/0 do or do not print KIM descriptor file, optional </UL> <P><B>Examples:</B> </P> Loading Loading @@ -48,6 +48,10 @@ potential as KIM defines it. In principle, LAMMPS can invoke any KIM model. You should get an error or warning message from either LAMMPS or KIM if there is an incompatibility. </P> <P>The argument <I>printflag</I> is optional. If it is set to a non-zero value then a KIM dsecriptor file is printed when KIM is invoked. This can be useful for debugging. The default is to not print this file. </P> <P>Only a single pair_coeff command is used with the <I>kim</I> style which specifies the mapping of LAMMPS atom types to KIM elements. This is done by specifying N additional arguments after the * * in the Loading doc/pair_kim.txt +6 −2 Original line number Diff line number Diff line Loading @@ -10,11 +10,11 @@ pair_style kim command :h3 [Syntax:] pair_style kim virialmode model print-flag :pre pair_style kim virialmode model printflag :pre virialmode = KIMvirial or LAMMPSvirial model = name of KIM model (potential) print-flag = 0/1 do/do not print kim descriptor file; default: 0 :ul printflag = 1/0 do or do not print KIM descriptor file, optional :ul [Examples:] Loading Loading @@ -45,6 +45,10 @@ potential as KIM defines it. In principle, LAMMPS can invoke any KIM model. You should get an error or warning message from either LAMMPS or KIM if there is an incompatibility. The argument {printflag} is optional. If it is set to a non-zero value then a KIM dsecriptor file is printed when KIM is invoked. This can be useful for debugging. The default is to not print this file. Only a single pair_coeff command is used with the {kim} style which specifies the mapping of LAMMPS atom types to KIM elements. This is done by specifying N additional arguments after the * * in the Loading Loading
doc/pair_kim.html +6 −2 Original line number Diff line number Diff line Loading @@ -13,11 +13,11 @@ </H3> <P><B>Syntax:</B> </P> <PRE>pair_style kim virialmode model print-flag <PRE>pair_style kim virialmode model printflag </PRE> <UL><LI>virialmode = KIMvirial or LAMMPSvirial <LI>model = name of KIM model (potential) <LI>print-flag = 0/1 do/do not print kim descriptor file; default: 0 <LI>printflag = 1/0 do or do not print KIM descriptor file, optional </UL> <P><B>Examples:</B> </P> Loading Loading @@ -48,6 +48,10 @@ potential as KIM defines it. In principle, LAMMPS can invoke any KIM model. You should get an error or warning message from either LAMMPS or KIM if there is an incompatibility. </P> <P>The argument <I>printflag</I> is optional. If it is set to a non-zero value then a KIM dsecriptor file is printed when KIM is invoked. This can be useful for debugging. The default is to not print this file. </P> <P>Only a single pair_coeff command is used with the <I>kim</I> style which specifies the mapping of LAMMPS atom types to KIM elements. This is done by specifying N additional arguments after the * * in the Loading
doc/pair_kim.txt +6 −2 Original line number Diff line number Diff line Loading @@ -10,11 +10,11 @@ pair_style kim command :h3 [Syntax:] pair_style kim virialmode model print-flag :pre pair_style kim virialmode model printflag :pre virialmode = KIMvirial or LAMMPSvirial model = name of KIM model (potential) print-flag = 0/1 do/do not print kim descriptor file; default: 0 :ul printflag = 1/0 do or do not print KIM descriptor file, optional :ul [Examples:] Loading Loading @@ -45,6 +45,10 @@ potential as KIM defines it. In principle, LAMMPS can invoke any KIM model. You should get an error or warning message from either LAMMPS or KIM if there is an incompatibility. The argument {printflag} is optional. If it is set to a non-zero value then a KIM dsecriptor file is printed when KIM is invoked. This can be useful for debugging. The default is to not print this file. Only a single pair_coeff command is used with the {kim} style which specifies the mapping of LAMMPS atom types to KIM elements. This is done by specifying N additional arguments after the * * in the Loading
