pub struct CalculatorResult {
pub energy: Option<f64>,
pub forces: Option<Vec<[f64; 3]>>,
}Fields§
§energy: Option<f64>§forces: Option<Vec<[f64; 3]>>Auto Trait Implementations§
impl Freeze for CalculatorResult
impl RefUnwindSafe for CalculatorResult
impl Send for CalculatorResult
impl Sync for CalculatorResult
impl Unpin for CalculatorResult
impl UnsafeUnpin for CalculatorResult
impl UnwindSafe for CalculatorResult
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Source§impl<T> BorrowMut<T> for Twhere
T: ?Sized,
impl<T> BorrowMut<T> for Twhere
T: ?Sized,
Source§fn borrow_mut(&mut self) -> &mut T
fn borrow_mut(&mut self) -> &mut T
Mutably borrows from an owned value. Read more
§impl<SS, SP> SupersetOf<SS> for SPwhere
SS: SubsetOf<SP>,
impl<SS, SP> SupersetOf<SS> for SPwhere
SS: SubsetOf<SP>,
§fn to_subset(&self) -> Option<SS>
fn to_subset(&self) -> Option<SS>
The inverse inclusion map: attempts to construct
self from the equivalent element of its
superset. Read more§fn is_in_subset(&self) -> bool
fn is_in_subset(&self) -> bool
Checks if
self is actually part of its subset T (and can be converted to it).§fn to_subset_unchecked(&self) -> SS
fn to_subset_unchecked(&self) -> SS
Use with care! Same as
self.to_subset but without any property checks. Always succeeds.§fn from_subset(element: &SS) -> SP
fn from_subset(element: &SS) -> SP
The inclusion map: converts
self to the equivalent element of its superset.