git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2368 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp 2009-01-09 22:22:53 +00:00
parent 74415cd5a2
commit b6dd359a78
4 changed files with 20 additions and 62 deletions

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@ -1097,16 +1097,20 @@ temperature.
<DD>Self-explanatory.
<DT><I>Compute used in variable is not current</I>
<DT><I>Compute used in variable between runs is not current</I>
<DD>Computes are not invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run.
<DD>Computes cannot be invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run in
order for their value(s) to be accessed. See the doc page for the
variable command for more info.
<DT><I>Compute used in variable thermo keyword is not current</I>
<DT><I>Compute used in variable thermo keyword between runs is not current</I>
<DD>Some thermo keywords rely on a compute to calculate their value(s).
Computes are not invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run.
Computes cannot be invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run in
order for their value(s) to be accessed. See the doc page for the
variable command for more info.
<DT><I>Compute vector in variable formula is too small</I>

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@ -1094,16 +1094,20 @@ An atom style is needed that has this attributes. :dd
Self-explanatory. :dd
{Compute used in variable is not current} :dt
{Compute used in variable between runs is not current} :dt
Computes are not invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run. :dd
Computes cannot be invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run in
order for their value(s) to be accessed. See the doc page for the
variable command for more info. :dd
{Compute used in variable thermo keyword is not current} :dt
{Compute used in variable thermo keyword between runs is not current} :dt
Some thermo keywords rely on a compute to calculate their value(s).
Computes are not invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run. :dd
Computes cannot be invoked by a variable in between runs. Thus they
must have been evaluated on the last timestep of the previous run in
order for their value(s) to be accessed. See the doc page for the
variable command for more info. :dd
{Compute vector in variable formula is too small} :dt

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@ -1,20 +0,0 @@
/* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
http://lammps.sandia.gov, Sandia National Laboratories
Steve Plimpton, sjplimp@sandia.gov
Copyright (2003) Sandia Corporation. Under the terms of Contract
DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
certain rights in this software. This software is distributed under
the GNU General Public License.
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#ifdef ComputeInclude
#include "compute_ackland_atom.h"
#endif
#ifdef ComputeClass
ComputeStyle(ackland/atom,ComputeAcklandAtom)
#endif

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@ -1,30 +0,0 @@
/* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
http://lammps.sandia.gov, Sandia National Laboratories
Steve Plimpton, sjplimp@sandia.gov
Copyright (2003) Sandia Corporation. Under the terms of Contract
DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
certain rights in this software. This software is distributed under
the GNU General Public License.
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
#ifdef KSpaceInclude
#include "ewald_n.h"
#endif
#ifdef KSpaceClass
KSpaceStyle(ewald/n,EwaldN)
#endif
#ifdef PairInclude
#include "pair_buck_coul.h"
#include "pair_lj_coul.h"
#endif
#ifdef PairClass
PairStyle(buck/coul,PairBuckCoul)
PairStyle(lj/coul,PairLJCoul)
#endif