Struct ElecRestoreFile 

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

This keyword specifies the name of the file from which wavefunction and density data should be restored when performing a CONTINUATION or a REUSE run. NULL means that wavefunction and density data will not be restored.

Note

The basis set and distribution for the new run must be the same as those from the run in which the data file was written.

Default

NULL

Example

ELEC_RESTORE_FILE : test.wvfn

Implementations

impl ElecRestoreFile

pub fn value(&self) -> &str

Trait Implementations

impl Clone for ElecRestoreFile

fn clone(&self) -> ElecRestoreFile

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Debug for ElecRestoreFile

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

Formats the value using the given formatter.

impl Default for ElecRestoreFile

fn default() -> ElecRestoreFile

Returns the “default value” for a type.

impl<'de> Deserialize<'de> for ElecRestoreFile

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

where __D: Deserializer<'de>,

Deserialize this value from the given Serde deserializer.

impl Display for ElecRestoreFile

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

Formats the value using the given formatter.

impl From<String> for ElecRestoreFile

fn from(value: String) -> Self

Converts to this type from the input type.

impl Hash for ElecRestoreFile

fn hash<__H: Hasher>(&self, state: &mut __H)

Feeds this value into the given Hasher.

fn hash_slice<H>(data: &[Self], state: &mut H)

where H: Hasher, Self: Sized,

Feeds a slice of this type into the given Hasher.

impl KeywordDisplay for ElecRestoreFile

fn field(&self) -> String

fn output(&self) -> String

impl Ord for ElecRestoreFile

fn cmp(&self, other: &ElecRestoreFile) -> Ordering

This method returns an Ordering between self and other.

fn max(self, other: Self) -> Self

where Self: Sized,

Compares and returns the maximum of two values.

fn min(self, other: Self) -> Self

where Self: Sized,

Compares and returns the minimum of two values.

fn clamp(self, min: Self, max: Self) -> Self

where Self: Sized,

Restrict a value to a certain interval.

impl PartialEq for ElecRestoreFile

fn eq(&self, other: &ElecRestoreFile) -> 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 ElecRestoreFile

fn partial_cmp(&self, other: &ElecRestoreFile) -> 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 ElecRestoreFile

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

where __S: Serializer,

Serialize this value into the given Serde serializer.

impl Eq for ElecRestoreFile

impl StructuralPartialEq for ElecRestoreFile