Struct SymmetryOp 

pub struct SymmetryOp {
    pub rotation: [[i8; 3]; 3],
    pub translation: [f64; 3],
}

A symmetry operation: rotation matrix (3×3 integers) + translation vector (rational, stored as f64).

Fields

rotation: [[i8; 3]; 3]

3×3 rotation matrix (integer elements).

translation: [f64; 3]

Translation vector (fractional coordinates).

Implementations

impl SymmetryOp

pub fn apply(&self, frac: &[f64; 3]) -> [f64; 3]

Apply this symmetry operation to fractional coordinates.

pub fn identity() -> Self

Identity operation.

pub fn inversion() -> Self

Inversion operation.

Trait Implementations

impl Clone for SymmetryOp

fn clone(&self) -> SymmetryOp

Returns a duplicate of the value.

fn clone_from(&mut self, source: &Self)

Performs copy-assignment from source.

impl Debug for SymmetryOp

fn fmt(&self, f: &mut Formatter<'_>) -> Result

Formats the value using the given formatter.

impl<'de> Deserialize<'de> for SymmetryOp

fn deserialize<__D>(__deserializer: __D) -> Result<Self, __D::Error>

where __D: Deserializer<'de>,

Deserialize this value from the given Serde deserializer.

impl Serialize for SymmetryOp

fn serialize<__S>(&self, __serializer: __S) -> Result<__S::Ok, __S::Error>

where __S: Serializer,

Serialize this value into the given Serde serializer.