Collaboration diagram for FannTwoParticleNetwork:

Public Member Functions
double	rescaleDistance (double r12) const

double	rescaleEnergy (double energy) const

double	rescaleEnergyDerivative (double value) const

double	tailCorrectionDampingFactor (double l12) const

double	tailCorrectionDampingFactorDerivative (double l12) const

double	headCorrectionEnergy (double l12) const

double	headCorrectionForce (double l12) const

Public Attributes
fann *	ann

double	r12Min

double	r12Max

double	tailCorrectionMin

double	tailCorrectionMax

double	headCorrectionMax

double	energyMin

double	energyMax

AtomType	atomType1

AtomType	atomType2

double	headCorrectionMaxDerivative

double	tailCorrectionMinDerivative

double	headCorrectionMaxEnergy

double	tailCorrectionMinEnergy

double	energyOffset

Member Function Documentation

double FannTwoParticleNetwork::headCorrectionEnergy ( double l12) const

double FannTwoParticleNetwork::headCorrectionForce ( double l12) const

double FannTwoParticleNetwork::rescaleDistance ( double r12) const

double FannTwoParticleNetwork::rescaleEnergy ( double energy) const

double FannTwoParticleNetwork::rescaleEnergyDerivative ( double value) const

double FannTwoParticleNetwork::tailCorrectionDampingFactor ( double l12) const

double FannTwoParticleNetwork::tailCorrectionDampingFactorDerivative ( double l12) const

Member Data Documentation

fann* FannTwoParticleNetwork::ann

AtomType FannTwoParticleNetwork::atomType1

AtomType FannTwoParticleNetwork::atomType2

double FannTwoParticleNetwork::energyMax

double FannTwoParticleNetwork::energyMin

double FannTwoParticleNetwork::energyOffset

double FannTwoParticleNetwork::headCorrectionMax

double FannTwoParticleNetwork::headCorrectionMaxDerivative

double FannTwoParticleNetwork::headCorrectionMaxEnergy

double FannTwoParticleNetwork::r12Max

double FannTwoParticleNetwork::r12Min

double FannTwoParticleNetwork::tailCorrectionMax

double FannTwoParticleNetwork::tailCorrectionMin

double FannTwoParticleNetwork::tailCorrectionMinDerivative

double FannTwoParticleNetwork::tailCorrectionMinEnergy

The documentation for this class was generated from the following files:

/home/svenni/Dropbox/projects/programming/emdee/emdee/src/libs/force/fanntwoparticleforce.h
/home/svenni/Dropbox/projects/programming/emdee/emdee/src/libs/force/fanntwoparticleforce.cpp