CoMD
A Mini-app for Co-Design of Classical Molecular Dynamics.
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Data Fields
ValidateSt Struct Reference

Simple struct to store the initial energy and number of atoms. More...

#include <CoMDTypes.h>

Data Fields

double eTot0
 
int nAtoms0
 

Detailed Description

Simple struct to store the initial energy and number of atoms.

Used to check energy conservation and atom conservation.

Definition at line 52 of file CoMDTypes.h.

Field Documentation

double ValidateSt::eTot0

Definition at line 54 of file CoMDTypes.h.

int ValidateSt::nAtoms0

Definition at line 55 of file CoMDTypes.h.

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