Vector space entry for ionic minimization (forces) More...

#include <IonicMinimizer.h>

Inheritance diagram for IonicGradient:

Public Member Functions
void	init (const class IonInfo &)
	initialize to zeroes with the correct species and atom numbers for iInfo

void	print (const Everything &, FILE , const char prefix="force") const

void	write (const char *fname) const

void	read (const char *fname)

IonicGradient &	*operator=** (double)

IonicGradient &	operator+= (const IonicGradient &)

IonicGradient	operator* (double) const

IonicGradient	operator+ (const IonicGradient &) const

IonicGradient	operator- (const IonicGradient &) const

Additional Inherited Members
Public Attributes inherited from std::vector< T >
T	elements
	STL member.

Detailed Description

Vector space entry for ionic minimization (forces)

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

Public Member Functions