energy
Class FDPoissonBoltzmann_ChargeGrid

java.lang.Object
  energy.FDPoissonBoltzmann
      energy.FDPoissonBoltzmann_ChargeGrid

public class FDPoissonBoltzmann_ChargeGrid

extends FDPoissonBoltzmann

Field Summary

(package private) int	gpxgpygpz The PoissonBoltzmann class constructor.
(package private) double	sumchrg

Fields inherited from class energy.FDPoissonBoltzmann

atoms, debug, epsCgrid, epsIgrid, epsJgrid, epsKgrid, epssolute, epssolvent, GPX, GPXGPY, GPXGPYGPZ, GPY, GPZ, gridspacing, gridstart, havephi, iccg, kappa, PBboundary, PBcrgGrid, PBeps, phigrid, rhogrid, sys

Constructor Summary

FDPoissonBoltzmann_ChargeGrid(Particles atoms, SimSystem sys, int gpxgpygpz)

FDPoissonBoltzmann_ChargeGrid(Particles atoms, SimSystem sys, int gpxgpygpz, int GPX, int GPY, int GPZ)

Method Summary

protected void

chargeGridtrilinear(double gridspacing, double[] gridstart, double[] rhogrid)

Methods inherited from class energy.FDPoissonBoltzmann

addParticles, dGelec, getgridstart, getpotential, gridcheck, index, setpermittivity, setupGrid, solveforpotential

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Field Detail

gpxgpygpz

final int gpxgpygpz

The PoissonBoltzmann class constructor.

sumchrg

double sumchrg

Constructor Detail

FDPoissonBoltzmann_ChargeGrid

public FDPoissonBoltzmann_ChargeGrid(Particles atoms,
                                     SimSystem sys,
                                     int gpxgpygpz)

FDPoissonBoltzmann_ChargeGrid

public FDPoissonBoltzmann_ChargeGrid(Particles atoms,
                                     SimSystem sys,
                                     int gpxgpygpz,
                                     int GPX,
                                     int GPY,
                                     int GPZ)

Method Detail

chargeGridtrilinear

protected void chargeGridtrilinear(double gridspacing,
                                   double[] gridstart,
                                   double[] rhogrid)