azizChen.H
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25 
26 Class
27  Foam::pairPotentials::azizChen
28 
29 Description
30 
31  Reference:
32  \verbatim
33  Aziz, R. A. & Chen, H.H. (1977).
34  An Accurate Intermolecular Potential for Argon.
35  Journal of Chemical Physics, Vol. 67, No. 12, p. 5179.
36  \endverbatim
37 
38 SourceFiles
39  azizChen.C
40 
41 \*---------------------------------------------------------------------------*/
42 
43 #ifndef azizChen_H
44 #define azizChen_H
45 
46 #include "pairPotential.H"
47 
48 // * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
49 
50 namespace Foam
51 {
52 
53 namespace pairPotentials
54 {
55 
56 /*---------------------------------------------------------------------------*\
57  Class azizChen Declaration
58 \*---------------------------------------------------------------------------*/
59 
60 class azizChen
61 :
62  public pairPotential
63 {
64  // Private data
65 
66  dictionary azizChenCoeffs_;
67 
68  scalar epsilon_;
69  scalar rm_;
70  scalar A_;
71  scalar alpha_;
72  scalar C6_;
73  scalar C8_;
74  scalar C10_;
75  scalar D_;
76  scalar gamma_;
77 
78 
79 public:
80 
81  //- Runtime type information
82  TypeName("azizChen");
83 
84 
85  // Constructors
86 
87  //- Construct from components
88  azizChen
89  (
90  const word& name,
92  );
93 
94 
95  //- Destructor
96  ~azizChen()
97  {}
98 
99 
100  // Member Functions
101 
102  scalar unscaledEnergy(const scalar r) const;
103 
104  //- Read dictionary
106 };
107 
108 
109 // * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
110 
111 } // End namespace pairPotentials
112 } // End namespace Foam
113 
114 // * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
115 
116 #endif
117 
118 // ************************************************************************* //
Foam::pairPotentials::azizChen::unscaledEnergy
scalar unscaledEnergy(const scalar r) const
Definition: azizChen.C:76
Foam::pairPotentials::azizChen
Reference:
Definition: azizChen.H:59
Foam::word
A class for handling words, derived from Foam::string.
Definition: word.H:65
Foam::pairPotentials::azizChen::TypeName
TypeName("azizChen")
Runtime type information.
Foam::pairPotentials::azizChen::azizChen
azizChen(const word &name, const dictionary &pairPotentialProperties)
Construct from components.
Definition: azizChen.C:53
Foam::pairPotentials::azizChen::~azizChen
~azizChen()
Destructor.
Definition: azizChen.H:95
Foam::dictionary
A list of keyword definitions, which are a keyword followed by a number of values (eg,...
Definition: dictionary.H:123
Foam::pairPotential
Definition: pairPotential.H:60
Foam::pairPotential::pairPotentialProperties
const dictionary & pairPotentialProperties() const
Definition: pairPotential.H:172
Foam
Namespace for OpenFOAM.
Definition: atmBoundaryLayer.C:33
Foam::pairPotentials::azizChen::read
bool read(const dictionary &pairPotentialProperties)
Read dictionary.
Definition: azizChen.C:101
Foam::name
word name(const expressions::valueTypeCode typeCode)
A word representation of a valueTypeCode. Empty for INVALID.
Definition: exprTraits.C:59
pairPotential.H