(0af78ca0) · Commits · 郑智淋 / lammps

doc/Section_intro.html

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		@@ -142,7 +142,7 @@ commands)
		<LI> manybody potentials: EAM, Finnis/Sinclair EAM, modified EAM (MEAM), embedded ion method (EIM), ADP, Stillinger-Weber, Tersoff, REBO, AIREBO, ReaxFF, COMB
		<LI> electron force field (eFF, AWPMD)
		<LI> coarse-grained potentials: DPD, GayBerne, REsquared, colloidal, DLVO
		<LI> mesoscopic potentials: granular, Peridynamics
		<LI> mesoscopic potentials: granular, Peridynamics, SPH
		<LI> bond potentials: harmonic, FENE, Morse, nonlinear, class 2, quartic (breakable)
		<LI> angle potentials: harmonic, CHARMM, cosine, cosine/squared, cosine/periodic, class 2 (COMPASS)
		<LI> dihedral potentials: harmonic, CHARMM, multi-harmonic, helix, class 2 (COMPASS), OPLS

doc/Section_packages.html

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		@@ -98,7 +98,7 @@ E.g. "peptide" refers to the examples/peptide directory.
		<TR ALIGN="center"><TD >USER-EFF</TD><TD > electron force field</TD><TD > Andres Jaramillo-Botero (Caltech)</TD><TD > <A HREF = "pair_eff.html">pair_style eff/cut</A></TD><TD > USER/eff</TD><TD > <A HREF = "http://lammps.sandia.gov/movies.html#eff">eff</A></TD><TD > -</TD></TR>
		<TR ALIGN="center"><TD >USER-EWALDN</TD><TD > Ewald for 1/R^n</TD><TD > Pieter in' t Veld (BASF)</TD><TD > <A HREF = "kspace_style.html">kspace_style</A></TD><TD > -</TD><TD > -</TD><TD > -</TD></TR>
		<TR ALIGN="center"><TD >USER-REAXC</TD><TD > C version of ReaxFF</TD><TD > Metin Aktulga (LBNL)</TD><TD > <A HREF = "pair_reax_c.html">pair_style reaxc</A></TD><TD > reax</TD><TD > -</TD><TD > -</TD></TR>
		<TR ALIGN="center"><TD >USER-SPH</TD><TD > smoothed particle hydrodynamics</TD><TD > Georg Ganzenmuller (EMI)</TD><TD > <A HREF = "USER/sph/SPH_LAMMPS_userguide.pdf">SPH_LAMMPS_userguide.pdf</A></TD><TD > USER/sph</TD><TD > <A HREF = "sph">sph</A></TD><TD > -</TD></TR>
		<TR ALIGN="center"><TD >USER-SPH</TD><TD > smoothed particle hydrodynamics</TD><TD > Georg Ganzenmuller (EMI)</TD><TD > <A HREF = "USER/sph/SPH_LAMMPS_userguide.pdf">SPH_LAMMPS_userguide.pdf</A></TD><TD > USER/sph</TD><TD > <A HREF = "http://lammps.sandia.gov/movies.html#sph">sph</A></TD><TD > -</TD></TR>
		<TR ALIGN="center"><TD >
		</TD></TR></TABLE></DIV>

		@@ -108,6 +108,8 @@ E.g. "peptide" refers to the examples/peptide directory.





		<P>The "Authors" column lists a name(s) if a specific person is
		responible for creating and maintaining the package.
		</P>

doc/Section_packages.txt

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		@@ -96,6 +96,7 @@ USER-SPH, smoothed particle hydrodynamics, Georg Ganzenmuller (EMI), "SPH_LAMMPS
		:link(atc,http://lammps.sandia.gov/pictures.html#atc)
		:link(cg,http://lammps.sandia.gov/pictures.html#cg)
		:link(eff,http://lammps.sandia.gov/movies.html#eff)
		:link(sph,http://lammps.sandia.gov/movies.html#sph)

		The "Authors" column lists a name(s) if a specific person is
		responible for creating and maintaining the package.

doc/compute_ackland_atom.html

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		@@ -51,10 +51,10 @@ which computes this quantity.-
		</P>
		<P><B>Output info:</B>
		</P>
		<P>This compute calculates a scalar quantity for each atom, which can be
		accessed by any command that uses per-atom values from a compute as
		input. See <A HREF = "Section_howto.html#howto_15">this section</A> for an overview
		of LAMMPS output options.
		<P>This compute calculates a per-atom vector, which can be accessed by
		any command that uses per-atom values from a compute as input. See
		<A HREF = "Section_howto.html#howto_15">this section</A> for an overview of LAMMPS
		output options.
		</P>
		<P><B>Restrictions:</B>
		</P>
		@@ -62,6 +62,9 @@ of LAMMPS output options.
		LAMMPS was built with that package. See the <A HREF = "Section_start.html#start_3">Making
		LAMMPS</A> section for more info.
		</P>
		<P>The per-atom vector values will be unitless since they are the
		integers defined above.
		</P>
		<P><B>Related commands:</B>
		</P>
		<P><A HREF = "compute_centro_atom.html">compute centro/atom</A>

doc/compute_meso_e_atom.html

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		@@ -31,15 +31,18 @@ for each atom in a group.
		of freedom of a mesoscopic particles, e.g. a Smooth-Particle
		Hydrodynamics particle.
		</P>
		<P>See <A HREF = "USER/sph/SPH_LAMMPS_userguide.pdf">this PDF guide</A> to using SPH in
		LAMMPS.
		</P>
		<P>The value of the internal energy will be 0.0 for atoms not in the
		specified compute group.
		</P>
		<P><B>Output info:</B>
		</P>
		<P>This compute calculates a scalar quantity for each atom, which can be
		accessed by any command that uses per-atom values from a compute as
		input. See <A HREF = "Section_howto.html#4_15">this section</A> for an overview of
		LAMMPS output options.
		<P>This compute calculates a per-atom vector, which can be accessed by
		any command that uses per-atom values from a compute as input. See
		<A HREF = "Section_howto.html#4_15">this section</A> for an overview of LAMMPS
		output options.
		</P>
		<P>The per-atom vector values will be in energy <A HREF = "units.html">units</A>.
		</P>

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