diff --git a/doc/src/Section_howto.txt b/doc/src/Section_howto.txt index f929d3bdabd32d1f8d2cb9351a3c6bcdc1248338..337880ccee186f3b7c3500627b8d5c6f43af8224 100644 --- a/doc/src/Section_howto.txt +++ b/doc/src/Section_howto.txt @@ -1158,7 +1158,7 @@ styles"_pair_style.html that generate torque: "pair_style lubricate"_pair_lubricate.html "pair_style line/lj"_pair_line_lj.html "pair_style tri/lj"_pair_tri_lj.html -"pair_style body"_pair_body.html :ul +"pair_style body"_pair_body_nparticle.html :ul The granular pair styles are used with spherical particles. The dipole pair style is used with the dipole atom style, which could be @@ -1269,7 +1269,7 @@ list of sub-particles. Individual body partices are typically treated as rigid bodies, and their motion integrated with a command like "fix nve/body"_fix_nve_body.html. Interactions between pairs of body particles are computed via a command like "pair_style -body"_pair_body.html. +body"_pair_body_nparticle.html. :line diff --git a/doc/src/fixes.txt b/doc/src/fixes.txt index 9510217d029b79849ad03fc8092090472936e4fe..7a45ed8086a14cdc201eea9cce5f28f80b4df00e 100644 --- a/doc/src/fixes.txt +++ b/doc/src/fixes.txt @@ -168,6 +168,8 @@ Fixes :h1 fix_viscosity fix_viscous fix_wall + fix_wall_body_polygon + fix_wall_body_polyhedron fix_wall_ees fix_wall_gran fix_wall_gran_region diff --git a/doc/src/pairs.txt b/doc/src/pairs.txt index 1a5e98a10964f63e7c2c3cfbf8a4faaef3967271..4c3eef2cd11c32ea4801ebb830a6a985cc5a734b 100644 --- a/doc/src/pairs.txt +++ b/doc/src/pairs.txt @@ -10,8 +10,9 @@ Pair Styles :h1 pair_airebo pair_awpmd pair_beck - pair_body + pair_body_nparticle pair_body_rounded_polygon + pair_body_rounded_polyhedron pair_bop pair_born pair_brownian diff --git a/examples/USER/diffraction/BulkNi.in b/examples/USER/diffraction/BulkNi.in index a18163175cf35f9d125307df4dc8c7534d5526a5..0fa9c1b74c2c41d9917d21b7167d4761403a2c2b 100644 --- a/examples/USER/diffraction/BulkNi.in +++ b/examples/USER/diffraction/BulkNi.in @@ -20,7 +20,7 @@ compute XRD all xrd 1.541838 Ni 2Theta 40 80 c 2 2 2 LP 1 echo compute SAED all saed 0.0251 Ni Kmax 0.85 Zone 1 0 0 c 0.025 0.025 0.025 & dR_Ewald 0.05 echo manual -fix 1 all ave/histo 1 1 1 40 80 200 c_XRD[1] c_XRD[2] & +fix 1 all ave/histo/weight 1 1 1 40 80 200 c_XRD[1] c_XRD[2] & mode vector file $A.hist.xrd fix 2 all saed/vtk 1 1 1 c_SAED file $A_001.saed diff --git a/src/MANYBODY/pair_eam_cd.h b/src/MANYBODY/pair_eam_cd.h index 15486aed6d96fafd13014296638bcdb82af30962..ee84fb09c53f9fed5c2808f8e784340b705b7679 100644 --- a/src/MANYBODY/pair_eam_cd.h +++ b/src/MANYBODY/pair_eam_cd.h @@ -18,8 +18,8 @@ PairStyle(eam/cd/old,PairEAMCD_TwoSite) #else -#ifndef LMP_PAIR_CDEAM_H -#define LMP_PAIR_CDEAM_H +#ifndef LMP_PAIR_EAM_CD_H +#define LMP_PAIR_EAM_CD_H #include "pair_eam_alloy.h" diff --git a/src/Purge.list b/src/Purge.list index cd4eb17dab5d142b0fde5bb4673d3266271645fd..cb98636b1c17860fab98343824d10bf5f2063bbf 100644 --- a/src/Purge.list +++ b/src/Purge.list @@ -24,6 +24,9 @@ style_nstencil.h style_ntopo.h # other auto-generated files lmpinstalledpkgs.h +# renamed on 31 July 2018 +pair_cdeam.h +pair_cdeam.cpp # renamed on 20 July 2018 pair_body.h pair_body.cpp