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adding molecular dynamics sources/app/utility

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andy
2008-05-22 15:03:46 +01:00
parent b5a7c032c6
commit 4a9f21ba18
131 changed files with 15306 additions and 0 deletions
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26
applications/utilities/preProcessing/molConfig/createPositions.H Executable file
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@ -0,0 +1,26 @@
vector latticePosition;
vector globalPosition;
if (latticeStructure == "SC")
{
# include "SC.H"
}
else if (latticeStructure == "FCC")
{
# include "FCC.H"
}
else if (latticeStructure == "BCC")
{
# include "BCC.H"
}
else
{
FatalErrorIn("createPositions.H\n")
<< "latticeStructure " << latticeStructure
<< " not supported."
<< abort(FatalError);
}