thole Struct Reference

#include <structures.h>

Public Attributes
int32	atom1
int32	atom2
int32	atom3
int32	atom4
Real	aa
Real	qq

Detailed Description

Definition at line 143 of file structures.h.

Member Data Documentation

aa

Real thole::aa

Definition at line 149 of file structures.h.

Referenced by TholeElem::computeForce().

atom1

int32 thole::atom1

Definition at line 145 of file structures.h.

Referenced by TholeElem::TholeElem().

atom2

int32 thole::atom2

Definition at line 146 of file structures.h.

Referenced by TholeElem::TholeElem().

atom3

int32 thole::atom3

Definition at line 147 of file structures.h.

Referenced by TholeElem::TholeElem().

atom4

int32 thole::atom4

Definition at line 148 of file structures.h.

Referenced by TholeElem::TholeElem().

qq

Real thole::qq

Definition at line 150 of file structures.h.

Referenced by TholeElem::computeForce().

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

• structures.h