pairPotentialIO.C
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25 
26 #include "pairPotential.H"
27 #include "IOstreams.H"
28 
30 {
31  Info<< "Writing energy and force tables to file for potential "
32  << name_ << endl;
33 
35 
37 
38  forAll(eTab, e)
39  {
40  os << eTab[e].first()
41  << token::SPACE
42  << eTab[e].second()
43  << token::SPACE
44  << fTab[e].second()
45  << nl;
46  }
47 
48  return os.good();
49 }
50 
51 
52 // ************************************************************************* //
#define forAll(list, i)
Loop across all elements in list.
Definition: UList.H:428
const double e
Elementary charge.
Definition: doubleFloat.H:78
A 1D array of objects of type <T>, where the size of the vector is known and used for subscript bound...
Definition: HashTable.H:59
List< Pair< scalar > > energyTable() const
bool good() const
Return true if next operation might succeed.
Definition: IOstream.H:333
Ostream & endl(Ostream &os)
Add newline and flush stream.
Definition: Ostream.H:253
T & first()
Return the first element of the list.
Definition: UListI.H:114
List< Pair< scalar > > forceTable() const
Useful combination of include files which define Sin, Sout and Serr and the use of IO streams general...
bool writeEnergyAndForceTables(Ostream &os) const
An Ostream is an abstract base class for all output systems (streams, files, token lists...
Definition: Ostream.H:53
static const char nl
Definition: Ostream.H:262
messageStream Info