From d2b3677d6fd83b8449eda71e28e83cd86e23c4cd Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Mon, 8 Feb 2021 21:45:58 -0500 Subject: [PATCH] whitespace fixes --- doc/src/thermo_style.rst | 6 +++--- src/USER-MISC/pair_agni.h | 2 +- src/fix_ave_correlate.cpp | 2 +- 3 files changed, 5 insertions(+), 5 deletions(-) diff --git a/doc/src/thermo_style.rst b/doc/src/thermo_style.rst index ac53e575e5..8ea487fd0a 100644 --- a/doc/src/thermo_style.rst +++ b/doc/src/thermo_style.rst @@ -23,7 +23,7 @@ Syntax atoms, temp, press, pe, ke, etotal, evdwl, ecoul, epair, ebond, eangle, edihed, eimp, emol, elong, etail, - enthalpy, ecouple, econserve, + enthalpy, ecouple, econserve, vol, density, lx, ly, lz, xlo, xhi, ylo, yhi, zlo, zhi, xy, xz, yz, xlat, ylat, zlat, bonds, angles, dihedrals, impropers, @@ -61,8 +61,8 @@ Syntax elong = long-range kspace energy etail = van der Waals energy long-range tail correction enthalpy = enthalpy (etotal + press\*vol) - ecouple = cumulative energy change due to thermo/baro statting fixes - econserve = pe + ke + ecouple = etotal + ecouple + ecouple = cumulative energy change due to thermo/baro statting fixes + econserve = pe + ke + ecouple = etotal + ecouple vol = volume density = mass density of system lx,ly,lz = box lengths in x,y,z diff --git a/src/USER-MISC/pair_agni.h b/src/USER-MISC/pair_agni.h index 58adc2002d..6fba506d04 100644 --- a/src/USER-MISC/pair_agni.h +++ b/src/USER-MISC/pair_agni.h @@ -50,7 +50,7 @@ class PairAGNI : public Pair { int *elem2param; // mapping from element pairs to parameters int *map; // mapping from atom types to elements int nparams; // # of stored parameter sets - int atomic_feature_version; // version of fingerprint + int atomic_feature_version; // version of fingerprint Param *params; // parameter set for an I-J interaction virtual void allocate(); void read_file(char *); diff --git a/src/fix_ave_correlate.cpp b/src/fix_ave_correlate.cpp index de0cc0da6f..efd06a182a 100644 --- a/src/fix_ave_correlate.cpp +++ b/src/fix_ave_correlate.cpp @@ -74,7 +74,7 @@ FixAveCorrelate::FixAveCorrelate(LAMMPS * lmp, int narg, char **arg): int iarg = 0; while (iarg < nargnew) { ArgInfo argi(arg[iarg]); - + if (argi.get_type() == ArgInfo::NONE) break; if ((argi.get_type() == ArgInfo::UNKNOWN) || (argi.get_dim() > 1)) error->all(FLERR,"Invalid fix ave/correlate command");