Struct MiePotentialF32
pub struct MiePotentialF32 {
pub radius: f32,
pub strength: f32,
pub bound: f32,
pub cutoff: f32,
pub en: f32,
pub em: f32,
}
Expand description
Generalizeation of the BoundLennardJones potential.
\begin{align} U(r) &= C\epsilon\left[ \left(\frac{\sigma}{r}\right)^n - \left(\frac{\sigma}{r}\right)^m\right]\\ C &= \frac{n}{n-m}\left(\frac{n}{m}\right)^{\frac{n}{n-m}}\\ V(r) &= \min(U(r), \beta)\theta(r-\zeta) \end{align}
This struct comes in a 64bit version MiePotential and a 32bit variant MiePotentialF32.
§References
G. Mie, “Zur kinetischen Theorie der einatomigen Körper,” Annalen der Physik, vol. 316, no. 8. Wiley, pp. 657–697, Jan. 1903. doi: 10.1002/andp.19033160802.
Fields§
§radius: f32
Interaction strength $\epsilon$ of the potential.
strength: f32
Overall size $\sigma$ of the object of the potential.
bound: f32
Numerical bound $\beta$ of the interaction strength.
cutoff: f32
Defines a cutoff $\zeta$ after which the potential will be fixed to exactly zero.
en: f32
Exponent $n$ of the potential
em: f32
Exponent $m$ of the potential
Implementations§
§impl MiePotentialF32
impl MiePotentialF32
pub fn new(
radius: f32,
strength: f32,
bound: f32,
cutoff: f32,
en: f32,
em: f32,
) -> MiePotentialF32
Available on crate feature cpu_os_threads
only.
pub fn new( radius: f32, strength: f32, bound: f32, cutoff: f32, en: f32, em: f32, ) -> MiePotentialF32
cpu_os_threads
only.Constructs a new MiePotentialF32
use cellular_raza_building_blocks::MiePotentialF32;
let (radius, strength, bound, cutoff, en, em) = (1.0, 1.0, 1.0, 1.0, 1.0, 1.0);
let mie_potential = MiePotentialF32::new(
radius,
strength,
bound,
cutoff,
en,
em,
);
Trait Implementations§
§impl Clone for MiePotentialF32
impl Clone for MiePotentialF32
§fn clone(&self) -> MiePotentialF32
fn clone(&self) -> MiePotentialF32
1.0.0 · Source§fn clone_from(&mut self, source: &Self)
fn clone_from(&mut self, source: &Self)
source
. Read more§impl Debug for MiePotentialF32
impl Debug for MiePotentialF32
§impl<'de> Deserialize<'de> for MiePotentialF32
impl<'de> Deserialize<'de> for MiePotentialF32
§fn deserialize<__D>(
__deserializer: __D,
) -> Result<MiePotentialF32, <__D as Deserializer<'de>>::Error>where
__D: Deserializer<'de>,
fn deserialize<__D>(
__deserializer: __D,
) -> Result<MiePotentialF32, <__D as Deserializer<'de>>::Error>where
__D: Deserializer<'de>,
§impl<const D: usize> Interaction<Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, f32> for MiePotentialF32
impl<const D: usize> Interaction<Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, f32> for MiePotentialF32
§fn calculate_force_between(
&self,
own_pos: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>,
_own_vel: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>,
ext_pos: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>,
_ext_vel: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>,
ext_radius: &f32,
) -> Result<(Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>), CalcError>
fn calculate_force_between( &self, own_pos: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, _own_vel: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, ext_pos: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, _ext_vel: &Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, ext_radius: &f32, ) -> Result<(Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>, Matrix<f32, Const<D>, Const<1>, ArrayStorage<f32, D, 1>>), CalcError>
§fn get_interaction_information(&self) -> f32
fn get_interaction_information(&self) -> f32
§fn is_neighbor(
&self,
own_pos: &Pos,
ext_pos: &Pos,
ext_inf: &Inf,
) -> Result<bool, CalcError>
fn is_neighbor( &self, own_pos: &Pos, ext_pos: &Pos, ext_inf: &Inf, ) -> Result<bool, CalcError>
§fn react_to_neighbors(&mut self, neighbors: usize) -> Result<(), CalcError>
fn react_to_neighbors(&mut self, neighbors: usize) -> Result<(), CalcError>
§impl IntoPy<Py<PyAny>> for MiePotentialF32
impl IntoPy<Py<PyAny>> for MiePotentialF32
§impl PartialEq for MiePotentialF32
impl PartialEq for MiePotentialF32
§impl PyClass for MiePotentialF32
impl PyClass for MiePotentialF32
§impl PyTypeInfo for MiePotentialF32
impl PyTypeInfo for MiePotentialF32
§fn type_object_raw(py: Python<'_>) -> *mut PyTypeObject
fn type_object_raw(py: Python<'_>) -> *mut PyTypeObject
§fn type_object_bound(py: Python<'_>) -> Bound<'_, PyType>
fn type_object_bound(py: Python<'_>) -> Bound<'_, PyType>
§fn is_type_of_bound(object: &Bound<'_, PyAny>) -> bool
fn is_type_of_bound(object: &Bound<'_, PyAny>) -> bool
object
is an instance of this type or a subclass of this type.§fn is_exact_type_of_bound(object: &Bound<'_, PyAny>) -> bool
fn is_exact_type_of_bound(object: &Bound<'_, PyAny>) -> bool
object
is an instance of this type.§impl Serialize for MiePotentialF32
impl Serialize for MiePotentialF32
§fn serialize<__S>(
&self,
__serializer: __S,
) -> Result<<__S as Serializer>::Ok, <__S as Serializer>::Error>where
__S: Serializer,
fn serialize<__S>(
&self,
__serializer: __S,
) -> Result<<__S as Serializer>::Ok, <__S as Serializer>::Error>where
__S: Serializer,
impl DerefToPyAny for MiePotentialF32
impl StructuralPartialEq for MiePotentialF32
Auto Trait Implementations§
impl Freeze for MiePotentialF32
impl RefUnwindSafe for MiePotentialF32
impl Send for MiePotentialF32
impl Sync for MiePotentialF32
impl Unpin for MiePotentialF32
impl UnwindSafe for MiePotentialF32
Blanket Implementations§
Source§impl<T> BorrowMut<T> for Twhere
T: ?Sized,
impl<T> BorrowMut<T> for Twhere
T: ?Sized,
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fn borrow_mut(&mut self) -> &mut T
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T: Clone,
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T: Clone,
§impl<T> FromPyObject<'_> for Twhere
T: PyClass + Clone,
impl<T> FromPyObject<'_> for Twhere
T: PyClass + Clone,
§fn extract_bound(obj: &Bound<'_, PyAny>) -> Result<T, PyErr>
fn extract_bound(obj: &Bound<'_, PyAny>) -> Result<T, PyErr>
§impl<'py, T> FromPyObjectBound<'_, 'py> for Twhere
T: FromPyObject<'py>,
impl<'py, T> FromPyObjectBound<'_, 'py> for Twhere
T: FromPyObject<'py>,
§fn from_py_object_bound(ob: Borrowed<'_, 'py, PyAny>) -> Result<T, PyErr>
fn from_py_object_bound(ob: Borrowed<'_, 'py, PyAny>) -> Result<T, PyErr>
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impl<T> Instrument for T
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variant of Either<Self, Self>
if into_left
is true
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Converts self
into a Right
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fn into_either_with<F>(self, into_left: F) -> Either<Self, Self> ⓘ
self
into a Left
variant of Either<Self, Self>
if into_left(&self)
returns true
.
Converts self
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impl<T> Pointable for T
§impl<T> PyErrArguments for T
impl<T> PyErrArguments for T
§impl<T> PyTypeCheck for Twhere
T: PyTypeInfo,
impl<T> PyTypeCheck for Twhere
T: PyTypeInfo,
§impl<SS, SP> SupersetOf<SS> for SPwhere
SS: SubsetOf<SP>,
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SS: SubsetOf<SP>,
§fn to_subset(&self) -> Option<SS>
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(and can be converted to it).§fn to_subset_unchecked(&self) -> SS
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but without any property checks. Always succeeds.§fn from_subset(element: &SS) -> SP
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to the equivalent element of its superset.