Enum BasisSetType 

pub enum BasisSetType {
    STO3G,
    DZ,
    DZP,
    TZP,
    CCPVDZ,
    CCPVTZ,
    CCPVQZ,
    AUGCCPVDZ,
    AUGCCPVTZ,
    Custom,
}

Basis set types

Variants

STO3G

Minimal basis set

DZ

Double-zeta basis

DZP

Double-zeta with polarization

TZP

Triple-zeta with polarization

CCPVDZ

Correlation-consistent basis sets

CCPVTZ

CCPVQZ

AUGCCPVDZ

Augmented correlation-consistent

AUGCCPVTZ

Custom

Custom basis set

Trait Implementations

impl Clone for BasisSetType

fn clone(&self) -> BasisSetType

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Debug for BasisSetType

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

Formats the value using the given formatter.

impl<'de> Deserialize<'de> for BasisSetType

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

where __D: Deserializer<'de>,

Deserialize this value from the given Serde deserializer.

impl PartialEq for BasisSetType

fn eq(&self, other: &BasisSetType) -> 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 Serialize for BasisSetType

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 BasisSetType

impl Eq for BasisSetType

impl StructuralPartialEq for BasisSetType