Struct feos_core::joback::JobackRecord

pub struct JobackRecord { /* private fields */ }

Coefficients used in the Joback model.

Contains an additional fourth order polynomial coefficient e which is not used in the original publication but is used in parametrization for additional molecules in other publications.

Implementations

impl JobackRecord

pub fn new(a: f64, b: f64, c: f64, d: f64, e: f64) -> Self

Creates a new JobackRecord

Trait Implementations

impl Clone for JobackRecord

fn clone(&self) -> JobackRecord

Returns a copy of the value.

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

Performs copy-assignment from source.

impl Debug for JobackRecord

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

Formats the value using the given formatter.

impl Default for JobackRecord

fn default() -> JobackRecord

Returns the “default value” for a type.

impl<'de> Deserialize<'de> for JobackRecord

fn deserialize<__D>(__deserializer: __D) -> Result<Self, __D::Error> where
    __D: Deserializer<'de>, 

Deserialize this value from the given Serde deserializer.

impl Display for JobackRecord

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

Formats the value using the given formatter.

impl FromSegments for JobackRecord

Implementation of the combining rules as described in Joback and Reid, 1987.

fn from_segments(segments: &[(Self, f64)]) -> Self

Constructs the record from a list of segment records with their number of occurences and possibly binary interaction parameters.

impl Serialize for JobackRecord

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

Serialize this value into the given Serde serializer.