Droplet.h¶

struct Monolayer¶

#include <Droplet.h>

Public Functions

Monolayer()¶

~Monolayer()¶

void setContext(Options _options, SimData *_simDataPtr, AtomArray *_atomArrayPtr)¶

void createHist(Grid &grid)¶

void deleteHist()¶

void calculateRadius()¶

void reset()¶

void fillOne(Atom &atom)¶

void fill(AtomArray &atoms)¶

bool inMonolayer(Atom &atom)¶

void convertUnits()¶

int monoFlux(vector<double> r, vector<double> z, double *monoLimits, double baseRadius, TH1D *rScaledJoin, TH1D *rScaledLeave, int &nMono)¶

void findMonoLimits(TH1D *hWaterDens, double *monoLimits)¶

Public Members

double radius¶

double height¶

Options options¶

SimData *simDataPtr¶

AtomArray *atomArrayPtr¶

double zlim[2]¶

TH1D *hMono¶

TanhFit tanhFit¶

bool histCreated¶

struct CircularBulk¶

#include <Droplet.h>

Public Functions

CircularBulk()¶

~CircularBulk()¶

void setContext(Options options, SimData *_simDataPtr, AtomArray *_atomArrayPtr)¶

void setHist(TH2D *_hDroplet)¶

void fillOne(Atom &atom)¶

void calculateHeight()¶

void calculateRadius()¶

void calculateContactAngle()¶

void calculateSphericalVolume()¶

void calculateCylindricalVolume()¶

bool pointOk(double r, double z)¶

void saveBoundaryPoints()¶

void findBoundaryPoints()¶

double fitCircle()¶

Public Members

int firstBulkBin¶

double height¶

double radius¶

double volume¶

double contactAngle¶

CircleFit circle¶

TanhFit tanhFit¶

Options options¶

SimData *simDataPtr¶

AtomArray *atomArrayPtr¶

TGraph *gCirclePoints¶

TH2D *hDroplet¶

int numPoints¶

double *boundaryPointsArray[2]¶

char *headers[2]¶

struct Droplet¶

#include <Droplet.h>

Public Functions

Droplet(AtomArray &atomArray)¶

~Droplet()¶

void setContext(AtomArray &atomArray)¶

void fillOne(Atom &atom)¶

void fill(AtomArray &atomArray)¶

void convertUnits()¶

void createHists()¶

void createCanvas()¶

void plotDensity(char *filename)¶

double getMass()¶

double getMass1D()¶

void reset()¶

void findMonolayer()¶

void dropletCalculations()¶

Public Members

CircularBulk bulk¶

Monolayer monolayer¶

Options options¶

SimData *simDataPtr¶

AtomArray *atomArrayPtr¶

TH2D *hDroplet¶

TH1D *hLiquidDens¶

TCanvas *cDroplet¶

double rDensCyl¶

struct monolayerTracker¶

#include <Droplet.h>

Public Members

int numMonoIDs¶

int *id¶

int *monoIDs¶

AtomArray monoAtoms¶