Clipper
Public Member Functions | List of all members
clipper::Grad_orth< T > Class Template Reference

orthogonal (Angstom) gradient, with respect to orthogonal x,y,z More...

#include <derivs.h>

Public Member Functions

Grad_frac< T > grad_frac (const Cell &cell) const
 orthogonal-fractional derivative conversion More...
 
String format () const
 return formatted String representation More...
 

Detailed Description

template<class T>
class clipper::Grad_orth< T >

orthogonal (Angstom) gradient, with respect to orthogonal x,y,z

Member Function Documentation

◆ grad_frac()

template<class T >
Grad_frac< T > clipper::Grad_orth< T >::grad_frac ( const Cell cell) const
inline

orthogonal-fractional derivative conversion

Parameters
cellThe cell concerned
Returns
The transformed derivative.

◆ format()

template<class T >
String clipper::Grad_orth< T >::format

return formatted String representation

The result is an RT operator. This is a redudent representation, but is handy for assembling compound operators.

Returns
The operator
The formatted text string

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