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MullikenCharges

qualia_core_db::specialized_libs::chemistry_modeling

Struct MullikenCharges 

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pub struct MullikenCharges {
    pub charges: Vec<f64>,
    pub total_charge: f64,
}
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Mulliken charges

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§charges: Vec<f64>§total_charge: f64

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impl MullikenCharges

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pub fn new() -> Self

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impl Clone for MullikenCharges

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fn clone(&self) -> MullikenCharges

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 MullikenCharges

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

Formats the value using the given formatter. Read more

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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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