Struct Charge 

pub struct Charge(/* private fields */);

Description This keyword specifies the total charge of the system. It can be used instead of NELECTRONS. It is not possible to specify the NELECTRONS, NUP, or NDOWN keywords when the CHARGE keyword is specified. Default 0 Example CHARGE : 3

Implementations

impl Charge

pub fn value(&self) -> f64

Trait Implementations

impl Clone for Charge

fn clone(&self) -> Charge

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Debug for Charge

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

Formats the value using the given formatter.

impl<'de> Deserialize<'de> for Charge

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

where __D: Deserializer<'de>,

Deserialize this value from the given Serde deserializer.

impl Display for Charge

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

Formats the value using the given formatter.

impl From<f64> for Charge

fn from(value: f64) -> Self

Converts to this type from the input type.

impl KeywordDisplay for Charge

fn field(&self) -> String

fn output(&self) -> String

impl PartialEq for Charge

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

Tests for self and other values to be equal, and is used by ==.

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

Tests for !=. The default implementation is almost always sufficient, and should not be overridden without very good reason.

impl PartialOrd for Charge

fn partial_cmp(&self, other: &Charge) -> Option<Ordering>

This method returns an ordering between self and other values if one exists.

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

Tests less than (for self and other) and is used by the < operator.

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

Tests less than or equal to (for self and other) and is used by the <= operator.

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

Tests greater than (for self and other) and is used by the > operator.

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

Tests greater than or equal to (for self and other) and is used by the >= operator.

impl Serialize for Charge

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

where __S: Serializer,

Serialize this value into the given Serde serializer.

impl Copy for Charge

impl StructuralPartialEq for Charge