Scine::Molassembler::Shapes::Data::Cube Struct Reference

A regular cube. More...

#include <Data.h>

Static Public Member Functions
static constexpr double	angleFunction (const unsigned a, const unsigned b)

Static Public Attributes
static constexpr Shape	shape = Shape::Cube
static constexpr PointGroup	pointGroup = PointGroup::Oh
static constexpr unsigned	size = 8
static constexpr char	stringName [] = "cube"
static constexpr std::array < Temple::Vector, 8 >	coordinates
	[V(CO)7]+ in C2v More...
static constexpr auto	angleLookupTable
static constexpr std::array < std::array< unsigned, 8 >, 2 >	rotations
static constexpr std::array < std::array< unsigned, 4 >, 2 >	tetrahedra
static constexpr std::array < unsigned, 8 >	mirror {{1, 0, 3, 2, 5, 4, 7, 6}}

Detailed Description

A regular cube.

Field Documentation

constexpr auto Scine::Molassembler::Shapes::Data::Cube::angleLookupTable

static

Initial value:

= Temple::makeUpperTriangularMatrix(
    Detail::makeArray<size>(coordinates)
  )

constexpr std::array<Temple::Vector, 8> Scine::Molassembler::Shapes::Data::Cube::coordinates

static

Initial value:

{{
    {  0.577350,  0.577350,  0.577350},
    {  0.577350, -0.577350,  0.577350},
    {  0.577350, -0.577350, -0.577350},
    {  0.577350,  0.577350, -0.577350},
    { -0.577350,  0.577350,  0.577350},
    { -0.577350, -0.577350,  0.577350},
    { -0.577350, -0.577350, -0.577350},
    { -0.577350,  0.577350, -0.577350}
  }}

[V(CO)7]+ in C2v

constexpr std::array< std::array<unsigned, 8>, 2 > Scine::Molassembler::Shapes::Data::Cube::rotations

static

Initial value:

{{
    {{3, 0, 1, 2, 7, 4, 5, 6}}, 
    {{4, 5, 1, 0, 7, 6, 2, 3}} 
  }}

constexpr std::array< std::array<unsigned, 4>, 2 > Scine::Molassembler::Shapes::Data::Cube::tetrahedra

static

Initial value:

{{
    {{0, 1, 3, 5}},
    {{2, 4, 6, 7}}
  }}

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

• Molassembler/Shapes/constexpr/Data.h