Struct DosConfig 

pub struct DosConfig {
    pub enabled: bool,
    pub partial_dos: bool,
    pub erange_ev: Option<(f64, f64)>,
    pub npoints: Option<usize>,
}

Configuration for DOS calculations

Fields

enabled: bool

Whether to compute electronic density of states

partial_dos: bool

Whether to compute partial DOS (per atom/orbital)

erange_ev: Option<(f64, f64)>

Energy range (min, max) in eV

npoints: Option<usize>

Number of energy points for DOS grid

Trait Implementations

impl Clone for DosConfig

fn clone(&self) -> DosConfig

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Debug for DosConfig

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

Formats the value using the given formatter.

impl<'de> Deserialize<'de> for DosConfig

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

where __D: Deserializer<'de>,

Deserialize this value from the given Serde deserializer.

impl Serialize for DosConfig

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

where __S: Serializer,

Serialize this value into the given Serde serializer.