tutorials/discreteMethods/molecularDynamics/mdEquilibrationFoam/periodicCubeWater/system/mdInitialiseDict

   1 /*---------------------------------------------------------------------------*\
   2 | =========                 |                                                 |
   3 | \\      /  F ield         | OpenFOAM: The Open Source CFD Toolbox           |
   4 |  \\    /   O peration     | Version:  1.6                                   |
   5 |   \\  /    A nd           | Web:      http://www.openfoam.org               |
   6 |    \\/     M anipulation  |                                                 |
   7 \*---------------------------------------------------------------------------*/
   8
   9 FoamFile
  10 {
  11     version         2.0;
  12     format          ascii;
  13
  14     root            "";
  15     case            "";
  16     instance        "";
  17     local           "";
  18
  19     class           dictionary;
  20     object          molConfigDict;
  21 }
  22
  23 // * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
  24
  25 // Euler angles, expressed in degrees as phi, theta, psi, see
  26 // http://mathworld.wolfram.com/EulerAngles.html
  27
  28 liquid
  29 {
  30     massDensity             980;
  31     temperature             298;
  32     bulkVelocity            (0.0 0.0 0.0);
  33     latticeIds
  34     (
  35         water
  36         water2
  37         water
  38         water2
  39     );
  40     tetherSiteIds           ();
  41     latticePositions
  42     (
  43         (0 0 0)
  44         (0 0.5 0.5)
  45         (0.5 0 0.5)
  46         (0.5 0.5 0)
  47     );
  48     anchor                  (0 0 0);
  49     orientationAngles       (0 0 0);
  50     latticeCellShape        (1 1 1);
  51 }
  52
  53 // ************************************************************************* //