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Added Allrun and Allclean scripts to gnemdFoam and mdEquilibrationFoam tutorials

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This commit is contained in:
graham
2008-07-03 17:49:51 +01:00
parent 06dec3884e
commit ba7d45228a
8 changed files with 175 additions and 12 deletions
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3
tutorials/gnemdFoam/constrictedChannel/constant/polyMesh/boundary
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@ -1,7 +1,7 @@
/*--------------------------------*- C++ -*----------------------------------*\
| ========= | |
| \\ / F ield | OpenFOAM: The Open Source CFD Toolbox |
| \\ / O peration | Version: 1.5 |
| \\ / O peration | Version: dev |
| \\ / A nd | Web: http://www.OpenFOAM.org |
| \\/ M anipulation | |
\*---------------------------------------------------------------------------*/
@ -10,6 +10,7 @@ FoamFile
version 2.0;
format ascii;
class polyBoundaryMesh;
location "constant/polyMesh";
object boundary;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //

13
tutorials/gnemdFoam/constrictedChannel/system/potentialDict
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@ -27,7 +27,7 @@ FoamFile
// automatically less valuable than any on the list. For molecules of the
// same type there is no control over which is removed.
removalOrder 1 (Ar);
removalOrder 2 (Ne Ar);
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
// Pair potentials
@ -111,19 +111,10 @@ tether
tetherPotential restrainedHarmonicSpring;
restrainedHarmonicSpringCoeffs
{
springConstant 0.0277;
springConstant 0.1;
rR 1.2e-9;
}
}
Ne
{
tetherPotential harmonicSpring;
harmonicSpringCoeffs
{
springConstant 0.0277;
}
}
}
// ************************************************************************* //