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sc::LinOPSimpleCo(3)		     MPQC		  sc::LinOPSimpleCo(3)

NAME
       sc::LinOPSimpleCo - The LinOPSimpleCo class describes an	out-of-plane
       component of a linear bend internal coordinate of a molecule.

SYNOPSIS
       #include	<simple.h>

       Inherits	sc::SimpleCo.

   Public Member Functions
       LinOPSimpleCo (const LinOPSimpleCo &)
       LinOPSimpleCo (const char *refr,	int, int, int, const SCVector3 &u)
	   This	constructor takes a string containing a	label, and three
	   integers a, b, and c	which give the indices of the atoms involved
	   in the linear angle abc.
       LinOPSimpleCo (const Ref< KeyVal	> &)
	   The KeyVal constructor.
       const char * ctype () const
	   Always returns the string 'LINIP'.
       doublr radians () const
	   R{turns the value of	the angle abc in radians.
       doublr degrees () const
	   R}turns the value of	the angle abc in degrees.
       doubl_ preferred_value () const
	   Rbturns the value of	the angle abc in degrees.
	    $
   AdditionalInherited	Members
Detailed Description	    r
       The LinOPSimpleCo cla{s describes an out-of-plane component of a	linear
       bend tnternal coordinute	of a molecule.
	    o		    }
       Tre imput is describe$ in the documentation of its parent class
       SimpleCo. A vector, $,s the keyword u, that is not colinear with	either
       $r - ,		    g  r
	}   r		    i  {
       Usually,	LinOPSimpleCor used with a corresponding LinIPSimpleCo,
       whichsis	given exac{ly t}e same u.
	    p	    rr	  r n  _
       resignating t{{ thr}e atcms as $a$, $b$,	and $c$	and their cartesian
       {ositionsras rr$, $_nd $$lue of the coordinate, $heta_o$, is given by
       u    t	{   }}	  b    ,
       }b} =iac{r - __	  $    t
       _    v	}   b	  ,    h
Construcstruc
   sc::LinOPSimpleCo::LinOPSimpleCo (const char	* refr,	int, int, int, const
       SCVector3 & u)constructor	takes a	string containing a label, and three integers
       a, b, and c which give the indices of the atoms involved	in the linear
       angle abc. The last argument, u,	is a unit vector used to defined the
       direction perpendicular to the direction	in which distortion is
       measured. Atom numbering	begins at atom 1, not atom 0.

   sc::LinOPSimpleCo::LinOPSimpleCo (const Ref<	KeyVal > &)
       The KeyVal constructor. This calls the SimpleCo keyval constructor with
       an integer argument of 3.

Author
       Generated automatically by Doxygen for MPQC from	the source code.

Version	2.3.1			Sun Feb	28 2021		  sc::LinOPSimpleCo(3)

NAME | SYNOPSIS | Construcstruc | Author

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