MPQC 2.3.1

sc::OutSimpleCo Class Reference

Inheritance diagram for sc::OutSimpleCo:
sc::SimpleCo sc::IntCoor sc::SavableState sc::DescribedClass sc::RefCount sc::Identity

List of all members.

Public Member Functions

 OutSimpleCo (const OutSimpleCo &)
 OutSimpleCo (const char *refr, int, int, int, int)
 This constructor takes a string containing a label, and four integers a, b, c, and d which give the indices of the atoms involved in the out-of-plane angle abcd.
 OutSimpleCo (const Ref< KeyVal > &)
 The KeyVal constructor.
const char * ctype () const
 Always returns the string "OUT".
double radians () const
 Returns the value of the angle abc in radians.
double degrees () const
 Returns the value of the angle abc in degrees.
double preferred_value () const
 Returns the value of the angle abc in degrees.

Constructor & Destructor Documentation

sc::OutSimpleCo::OutSimpleCo ( const char *  refr,
int  ,
int  ,
int  ,
int   
)

This constructor takes a string containing a label, and four integers a, b, c, and d which give the indices of the atoms involved in the out-of-plane angle abcd.

Atom numbering begins at atom 1, not atom 0.

sc::OutSimpleCo::OutSimpleCo ( const Ref< KeyVal > &  )

The KeyVal constructor.

This calls the SimpleCo keyval constructor with an integer argument of 4.


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

Generated at Fri Feb 11 2011 12:02:56 for MPQC 2.3.1 using the documentation package Doxygen 1.7.3.