reflection 'Miller' index More...
#include <hkl_datatypes.hh>
Inherits clipper::Vec3< int >.
Public Member Functions | |
| Hkl () | |
| null constructor | |
| Hkl (const Vec3< int > &v) | |
| constructor: copy/convert | |
| Hkl (const int &h, const int &k, const int &l) | |
| constructor: from H,K,L | |
| Hkl (const Vec3< double > &d) | |
| constructor from double | |
| Hkl (const clipper::HKL &chkl) | |
| constructor from clipper::HKL | |
| const int & | h () const |
| get h | |
| const int & | k () const |
| get k | |
| const int & | l () const |
| get l | |
| int & | h () |
| set h | |
| int & | k () |
| set k | |
| int & | l () |
| set l | |
| bool | IsGeneral () const |
| clipper::HKL | HKL () const |
| return clipper HKL | |
| Vec3< Dtype > | real () const |
| return real version of hkl | |
| Dtype | invresolsq (const Scell &cell) const |
| return inverse resolution squared for this reflection in given cell | |
| Hkl | change_basis (const ReindexOp &reindex_op) const |
| change basis: new h' = h * reindex_op | |
| bool | change_basis (Hkl &Newhkl, const ReindexOp &reindex_op) const |
| change basis: new h' = h * reindex_op. return false if indices are non-integral | |
| Vec3< Dtype > | orth (const Scell &cell) const |
| return orthogonalised vector [B] h | |
| std::string | format () const |
| int | code () const |
| returned packed form as index code | |
Friends | |
| Hkl | operator- (const Hkl &h1) |
| Hkl | operator+ (const Hkl &h1, const Hkl &h2) |
| Hkl | operator- (const Hkl &h1, const Hkl &h2) |
| Hkl | operator* (const int &s, const Hkl &h1) |
reflection 'Miller' index
Copied from Clipper::HKL with some simplifications
| std::string scala::Hkl::format | ( | ) | const |
return formatted String representation
| bool scala::Hkl::IsGeneral | ( | ) | const |
true if not in any potential zero level
1.6.3
