lindhard::electron::elastic::corrections

Struct CorrelationPolarization

pub struct CorrelationPolarization {
    pub polarizability: f64,
    pub polarizability_source: String,
    pub cutoff: PolarizationCutoff,
    pub outer_radius: f64,
}

Expand description

Inputs of the correlation-polarization correction.

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§polarizability: f64

Static dipole polarizability alpha_p of the target atom, bohr^3 (atomic units of polarizability).

§polarizability_source: String

Citation of polarizability (recorded in the metadata; must not be empty).

§cutoff: PolarizationCutoff

Cutoff parameter of the Buckingham potential.

§outer_radius: f64

Radius beyond which the polarization tail is dropped, bohr (a numerical setting, see the module docs).

Implementations§

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impl CorrelationPolarization

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pub fn new( polarizability: f64, polarizability_source: impl Into<String>, ) -> Self

Seltzer’s cutoff and DEFAULT_OUTER_RADIUS.

Trait Implementations§

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impl Clone for CorrelationPolarization

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fn clone(&self) -> CorrelationPolarization

Returns a duplicate of the value. Read more

1.0.0 (const: unstable) · Source§

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

Performs copy-assignment from source. Read more

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impl Debug for CorrelationPolarization

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

Formats the value using the given formatter. Read more

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impl PartialEq for CorrelationPolarization

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fn eq(&self, other: &CorrelationPolarization) -> bool

Equality operator ==. Read more

1.0.0 (const: unstable) · Source§

fn ne(&self, other: &Rhs) -> bool

Inequality operator !=. Read more

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impl StructuralPartialEq for CorrelationPolarization

Auto Trait Implementations§

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impl UnwindSafe for CorrelationPolarization

Blanket Implementations§

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impl<T> Any for T
where T: 'static + ?Sized,

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fn type_id(&self) -> TypeId

Gets the TypeId of self. Read more

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impl<T> Borrow<T> for T
where T: ?Sized,

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fn borrow(&self) -> &T

Immutably borrows from an owned value. Read more

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impl<T> BorrowMut<T> for T
where T: ?Sized,

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fn borrow_mut(&mut self) -> &mut T

Mutably borrows from an owned value. Read more

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impl<ST, DT> CastableFrom<ST, Initialized, Initialized> for DT
where ST: ?Sized, DT: ?Sized,

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impl<ST, DT> CastableFrom<ST, Uninit, Uninit> for DT
where ST: ?Sized, DT: ?Sized,

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impl<T> CloneToUninit for T
where T: Clone,

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unsafe fn clone_to_uninit(&self, dest: *mut u8)

🔬This is a nightly-only experimental API. (clone_to_uninit)

Performs copy-assignment from self to dest. Read more

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impl<T> From<T> for T

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fn from(t: T) -> T

Returns the argument unchanged.

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impl<T, U> Into for T
where U: From<T>,

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fn into(self) -> U

Calls U::from(self).

That is, this conversion is whatever the implementation of From<T> for U chooses to do.

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impl<T> IntoEither for T

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fn into_either(self, into_left: bool) -> Either<Self, Self> ⓘ

Converts self into a Left variant of Either<Self, Self> if into_left is true. Converts self into a Right variant of Either<Self, Self> otherwise. Read more

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fn into_either_with<F>(self, into_left: F) -> Either<Self, Self> ⓘ
where F: FnOnce(&Self) -> bool,

Converts self into a Left variant of Either<Self, Self> if into_left(&self) returns true. Converts self into a Right variant of Either<Self, Self> otherwise. Read more

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