Merge branch 'molecularDynamics'

This commit is contained in:
andy
2008-06-27 18:25:53 +01:00
4 changed files with 5 additions and 6 deletions

View File

@ -57,7 +57,6 @@ class shifted
scalar e_at_rCut_;
public:
//- Runtime type information

View File

@ -63,7 +63,7 @@ pair
shift2 0.97e-9;
scale2 1.2e11;
}
writeTables yes;
writeTables no;
}
Ar-Ne
@ -80,7 +80,7 @@ pair
epsilon 8.765026657e-22;
}
energyScalingFunction shiftedForce;
writeTables yes;
writeTables no;
}
Ne-Ne
@ -97,7 +97,7 @@ pair
epsilon 5.813260729e-22;
}
energyScalingFunction shiftedForce;
writeTables yes;
writeTables no;
}
}

View File

@ -20,7 +20,7 @@ startTime 0;
stopAt endTime;
endTime 4e-10;
endTime 1e-10;
deltaT 1e-14;

View File

@ -3,7 +3,7 @@
. $WM_PROJECT_DIR/bin/tools/RunFunctions
# Get application name from directory
application=`basename $PWD`
application="mdEquilibrationFoam"
(cd hartmann && runApplication blockMesh)
(cd hartmann && runApplication $application)