The fundamental simulation data structure with MAXATOMS in every link cell. More...

#include <CoMDTypes.h>

Collaboration diagram for SimFlatSt:

Data Fields
int	nSteps

int	printRate

double	dt

Domain *	domain

LinkCell *	boxes

Atoms *	atoms

SpeciesData *	species

real_t	ePotential
	the total potential energy of the system More...

real_t	eKinetic
	the total kinetic energy of the system More...

BasePotential *	pot
	the potential More...

HaloExchange *	atomExchange

Detailed Description

The fundamental simulation data structure with MAXATOMS in every link cell.

Definition at line 62 of file CoMDTypes.h.

Field Documentation

HaloExchange* SimFlatSt::atomExchange

Definition at line 81 of file CoMDTypes.h.

Atoms* SimFlatSt::atoms

Definition at line 72 of file CoMDTypes.h.

LinkCell* SimFlatSt::boxes

Definition at line 70 of file CoMDTypes.h.

Domain* SimFlatSt::domain

Definition at line 68 of file CoMDTypes.h.

double SimFlatSt::dt

Definition at line 66 of file CoMDTypes.h.

real_t SimFlatSt::eKinetic

the total kinetic energy of the system

Definition at line 77 of file CoMDTypes.h.

real_t SimFlatSt::ePotential

the total potential energy of the system

Definition at line 76 of file CoMDTypes.h.

int SimFlatSt::nSteps

Definition at line 64 of file CoMDTypes.h.

BasePotential* SimFlatSt::pot

the potential

Definition at line 79 of file CoMDTypes.h.

int SimFlatSt::printRate

Definition at line 65 of file CoMDTypes.h.

SpeciesData* SimFlatSt::species

Definition at line 74 of file CoMDTypes.h.

The documentation for this struct was generated from the following file: