Foam::pairPotentials::maitlandSmith. More...
#include <potential/maitlandSmith.H>
Foam::pairPotentials::maitlandSmith.
@ARTICLE{MA_Maitland_Smith, author = {{Maitland}, G.~C. and {Smith}, E.~B.}, title = {A simplified representation of intermolecular potential energy}, journal = {Chemical Physics Letters}, year = 1973, month = oct, volume = 22, pages = {443-446}, adsurl = {http://adsabs.harvard.edu/abs/1973CPL....22..443M}, adsnote = {Provided by the SAO/NASA Astrophysics Data System} }
Parameters for other monoatomics from:
@BOOK{MD_Maitland_Rigby_Smith_Wakeham, AUTHOR = {Geoffrey C. Maitland and Maurice Rigby and E. Brian Smith and William A. Wakeham}, TITLE ={Intermolecular Forces: Their Origin and Determination}, PUBLISHER ={Oxford University Press}, YEAR = {1981} }
Definition at line 77 of file maitlandSmith.H.
Public Member Functions | |
TypeName ("maitlandSmith") | |
Runtime type information. | |
maitlandSmith (const word &name, const dictionary &pairPotentialProperties) | |
Construct from components. | |
~maitlandSmith () | |
scalar | unscaledEnergy (const scalar r) const |
bool | read (const dictionary &pairPotentialProperties) |
Read dictionary. | |
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TypeName ("pairPotential") | |
Runtime type information. | |
declareRunTimeSelectionTable (autoPtr, pairPotential, dictionary,(const word &name, const dictionary &pairPotentialProperties),(name, pairPotentialProperties)) | |
pairPotential (const word &name, const dictionary &pairPotentialProperties) | |
Construct from components. | |
virtual | ~pairPotential () |
void | setLookupTables () |
scalar | rMin () const |
scalar | dr () const |
scalar | rCut () const |
scalar | rCutSqr () const |
scalar | energy (const scalar r) const |
scalar | force (const scalar r) const |
List< Pair< scalar > > | energyTable () const |
List< Pair< scalar > > | forceTable () const |
bool | writeTables () const |
scalar | scaledEnergy (const scalar r) const |
scalar | energyDerivative (const scalar r, const bool scaledEnergyDerivative=true) const |
const dictionary & | pairPotentialProperties () const |
bool | writeEnergyAndForceTables (Ostream &os) const |
Additional Inherited Members | |
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static autoPtr< pairPotential > | New (const word &name, const dictionary &pairPotentialProperties) |
Return a reference to the selected viscosity model. | |
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void | scaleEnergy (scalar &e, const scalar r) const |
pairPotential (const pairPotential &) | |
Disallow copy construct. | |
void | operator= (const pairPotential &) |
Disallow default bitwise assignment. | |
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word | name_ |
dictionary | pairPotentialProperties_ |
scalar | rCut_ |
scalar | rCutSqr_ |
scalar | rMin_ |
scalar | dr_ |
List< scalar > | forceLookup_ |
List< scalar > | energyLookup_ |
energyScalingFunction * | esfPtr_ |
bool | writeTables_ |
maitlandSmith | ( | const word & | name, |
const dictionary & | pairPotentialProperties | ||
) |
Construct from components.
Definition at line 51 of file maitlandSmith.C.
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inline |
Definition at line 109 of file maitlandSmith.H.
TypeName | ( | "maitlandSmith" | ) |
Runtime type information.
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virtual |
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virtual |
Read dictionary.
Implements pairPotential.
Definition at line 81 of file maitlandSmith.C.
References dictionary::lookup(), and dictionary::subDict().