Struct qsym2 :: symmetry :: symmetry_element :: SymmetryElementBuilder Copy item path

impl SymmetryElementBuilder

pub fn proper_order(&mut self, value: ElementOrder) -> &mut Self

The rotational order $n$ of the proper rotation part of the symmetry element. This can be finite or infinite, and will determine whether the proper power is None or contains an integer value.

pub fn kind(&mut self, value: SymmetryElementKind) -> &mut Self

The spatial and antiunitary kind of the symmetry element.

pub fn rotation_group(&mut self, value: RotationGroup) -> &mut Self

The rotation group in which the proper rotation part of the symmetry element shall be interpreted.

pub fn generator(&mut self, value: bool) -> &mut Self

A boolean indicating whether the symmetry element is a generator of the group to which it belongs.

pub fn additional_superscript(&mut self, value: String) -> &mut Self

An additional superscript for distinguishing symmetry elements.

pub fn additional_subscript(&mut self, value: String) -> &mut Self

An additional subscript for distinguishing symmetry elements.

pub fn build(&self) -> Result<SymmetryElement, SymmetryElementBuilderError>

Builds a new SymmetryElement.

§Errors

If a required field has not been initialized.

impl SymmetryElementBuilder

pub fn proper_power(&mut self, prop_pow: i32) -> &mut Self

Sets the proper power of the element.

§Arguments

prop_pow - A proper power to be set. This will be folded into the interval $(\lfloor -n/2 \rfloor, \lfloor n/2 \rfloor]$.

pub fn proper_angle(&mut self, ang: f64) -> &mut Self

Sets the proper rotation angle of the infinite-order element.

§Arguments

ang - A proper rotation angle to be set. This will be folded into the interval $(-\pi, \pi]$.

§Panics

Panics when self is of finite order.

pub fn raw_axis(&mut self, axs: Vector3<f64>) -> &mut Self

Sets the raw axis of the element.

§Arguments

axs - The raw axis which will be normalised.

pub fn threshold(&mut self, thresh: f64) -> &mut Self

Sets the comparison threshold of the element.

§Arguments

thresh - The comparison threshold..

Trait Implementations§

impl Clone for SymmetryElementBuilder

fn clone(&self) -> SymmetryElementBuilder

Returns a copy of the value. Read more

1.0.0 · source§

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

Performs copy-assignment from source. Read more

impl Default for SymmetryElementBuilder

fn default() -> Self

Returns the “default value” for a type. Read more

Auto Trait Implementations§

impl UnwindSafe for SymmetryElementBuilder

Blanket Implementations§

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