From bb597d34c6314ca6f5c2f673110b1007f300e4a8 Mon Sep 17 00:00:00 2001 From: graham Date: Thu, 3 Jul 2008 17:59:04 +0100 Subject: [PATCH] changed timestep control in molecule::move to tEnd > ROOTVSMALL --- src/lagrangian/molecularDynamics/molecule/molecule/molecule.C | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C b/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C index 88b6a8813b..ea7d52771c 100644 --- a/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C +++ b/src/lagrangian/molecularDynamics/molecule/molecule/molecule.C @@ -54,7 +54,7 @@ bool molecule::move(molecule::trackData& td) U_ += 0.5*deltaT*A_; } - while (td.keepParticle && !td.switchProcessor && tEnd > (SMALL*SMALL)) + while (td.keepParticle && !td.switchProcessor && tEnd > ROOTVSMALL) { // set the lagrangian time-step scalar dt = min(dtMax, tEnd);