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foam-extend4.1-coherent-io/tutorials/discreteMethods/molecularDynamics/mdEquilibrationFoam/periodicCubeWater/system/mdInitialiseDict

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/*--------------------------------*- C++ -*----------------------------------*\
| ========= | |
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| \\ / F ield | foam-extend: Open Source CFD |
2016-06-20 15:00:40 +00:00
| \\ / O peration | Version: 4.0 |
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| \\ / A nd | Web: http://www.foam-extend.org |
| \\/ M anipulation | |
\*---------------------------------------------------------------------------*/
FoamFile
{
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version 2.0;
format ascii;
class dictionary;
object molConfigDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
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// Euler angles, expressed in degrees as phi, theta, psi, see
// http://mathworld.wolfram.com/EulerAngles.html
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liquid
{
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massDensity 980;
temperature 298;
bulkVelocity (0.0 0.0 0.0);
latticeIds
(
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water
water2
water
water2
);
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tetherSiteIds ();
latticePositions
(
(0 0 0)
(0 0.5 0.5)
(0.5 0 0.5)
(0.5 0.5 0)
);
anchor (0 0 0);
orientationAngles (0 0 0);
latticeCellShape (1 1 1);
}
// ************************************************************************* //