Clipper
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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... | |
orthogonal (Angstom) gradient, with respect to orthogonal x,y,z
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inline |
orthogonal-fractional derivative conversion
cell | The cell concerned |
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.