pub struct SymmetryElementBuilder { /* private fields */ }
Expand description

Builder for SymmetryElement.

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impl SymmetryElementBuilder

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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.

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

The spatial and antiunitary kind of the symmetry element.

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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.

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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.

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

An additional superscript for distinguishing symmetry elements.

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

An additional subscript for distinguishing symmetry elements.

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

Builds a new SymmetryElement.

§Errors

If a required field has not been initialized.

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impl SymmetryElementBuilder

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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 $(\lfloor -n/2 \rfloor, \lfloor n/2 \rfloor]$.
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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.

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

Sets the comparison threshold of the element.

§Arguments
  • thresh - The comparison threshold..

Trait Implementations§

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impl Clone for SymmetryElementBuilder

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fn clone(&self) -> SymmetryElementBuilder

Returns a copy of the value. Read more
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fn clone_from(&mut self, source: &Self)

Performs copy-assignment from source. Read more
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impl Default for SymmetryElementBuilder

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fn default() -> Self

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

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