#[cfg(test)]
mod test;
use crate::{
constitutive::{
ConstitutiveError,
solid::{FIVE_THIRDS, Solid, TWO_THIRDS, elastic::Elastic, hyperelastic::Hyperelastic},
},
math::{IDENTITY, Rank2},
mechanics::{CauchyStress, CauchyTangentStiffness, Deformation, DeformationGradient, Scalar},
physics::molecular::single_chain::Thermodynamics as SingleChainThermodynamics,
};
use std::{
any::type_name,
fmt::{self, Debug, Formatter},
};
#[doc = include_str!("doc.md")]
#[derive(Clone)]
pub struct EightChain<T>
where
T: SingleChainThermodynamics,
{
pub bulk_modulus: Scalar,
pub shear_modulus: Scalar,
pub single_chain_model: T,
}
impl<T> Debug for EightChain<T>
where
T: SingleChainThermodynamics,
{
fn fmt(&self, f: &mut Formatter<'_>) -> fmt::Result {
write!(
f,
"EightChain {{ bulk_modulus: {}, shear_modulus: {}, single_chain_model: {} }}",
self.bulk_modulus,
self.shear_modulus,
type_name::<T>()
.rsplit("::")
.next()
.unwrap()
.split("<")
.next()
.unwrap(),
)
}
}
impl<T> EightChain<T>
where
T: SingleChainThermodynamics,
{
fn nondimensional_force(
&self,
nondimensional_extension: Scalar,
) -> Result<Scalar, ConstitutiveError> {
match SingleChainThermodynamics::nondimensional_force(
&self.single_chain_model,
nondimensional_extension,
) {
Ok(nondimensional_force) => Ok(nondimensional_force),
Err(error) => Err(ConstitutiveError::Upstream(
format!("{error}"),
format!("{self:?}"),
)),
}
}
fn nondimensional_stiffness(
&self,
nondimensional_extension: Scalar,
) -> Result<Scalar, ConstitutiveError> {
match SingleChainThermodynamics::nondimensional_stiffness(
&self.single_chain_model,
nondimensional_extension,
) {
Ok(nondimensional_stiffness) => Ok(nondimensional_stiffness),
Err(error) => Err(ConstitutiveError::Upstream(
format!("{error}"),
format!("{self:?}"),
)),
}
}
pub fn number_of_links(&self) -> Scalar {
self.single_chain_model.number_of_links() as Scalar
}
pub fn single_chain_model(&self) -> &T {
&self.single_chain_model
}
}
impl<T> Solid for EightChain<T>
where
T: SingleChainThermodynamics,
{
fn bulk_modulus(&self) -> Scalar {
self.bulk_modulus
}
fn shear_modulus(&self) -> Scalar {
self.shear_modulus
}
}
impl<T> Elastic for EightChain<T>
where
T: SingleChainThermodynamics,
{
#[doc = include_str!("cauchy_stress.md")]
fn cauchy_stress(
&self,
deformation_gradient: &DeformationGradient,
) -> Result<CauchyStress, ConstitutiveError> {
let jacobian = self.jacobian(deformation_gradient)?;
let (
deviatoric_isochoric_left_cauchy_green_deformation,
isochoric_left_cauchy_green_deformation_trace,
) = (deformation_gradient.left_cauchy_green() / jacobian.powf(TWO_THIRDS))
.deviatoric_and_trace();
let gamma =
(isochoric_left_cauchy_green_deformation_trace / 3.0 / self.number_of_links()).sqrt();
let gamma_0 = (1.0 / self.number_of_links()).sqrt();
Ok(deviatoric_isochoric_left_cauchy_green_deformation
* (self.shear_modulus() * self.nondimensional_force(gamma)?
/ self.nondimensional_force(gamma_0)?
* gamma_0
/ gamma
/ jacobian)
+ IDENTITY * self.bulk_modulus() * 0.5 * (jacobian - 1.0 / jacobian))
}
#[doc = include_str!("cauchy_tangent_stiffness.md")]
fn cauchy_tangent_stiffness(
&self,
deformation_gradient: &DeformationGradient,
) -> Result<CauchyTangentStiffness, ConstitutiveError> {
let jacobian = self.jacobian(deformation_gradient)?;
let inverse_transpose_deformation_gradient = deformation_gradient.inverse_transpose();
let left_cauchy_green_deformation = deformation_gradient.left_cauchy_green();
let deviatoric_left_cauchy_green_deformation = left_cauchy_green_deformation.deviatoric();
let (
deviatoric_isochoric_left_cauchy_green_deformation,
isochoric_left_cauchy_green_deformation_trace,
) = (left_cauchy_green_deformation / jacobian.powf(TWO_THIRDS)).deviatoric_and_trace();
let gamma =
(isochoric_left_cauchy_green_deformation_trace / 3.0 / self.number_of_links()).sqrt();
let gamma_0 = (1.0 / self.number_of_links()).sqrt();
let eta = self.nondimensional_force(gamma)?;
let scaled_shear_modulus =
gamma_0 / self.nondimensional_force(gamma_0)? * self.shear_modulus() * eta
/ gamma
/ jacobian.powf(FIVE_THIRDS);
let scaled_deviatoric_isochoric_left_cauchy_green_deformation =
deviatoric_left_cauchy_green_deformation * scaled_shear_modulus;
let term = CauchyTangentStiffness::dyad_ij_kl(
&scaled_deviatoric_isochoric_left_cauchy_green_deformation,
&(deviatoric_isochoric_left_cauchy_green_deformation
* &inverse_transpose_deformation_gradient
* ((self.nondimensional_stiffness(gamma)? / eta - 1.0 / gamma)
/ 3.0
/ self.number_of_links()
/ gamma)),
);
Ok(
(CauchyTangentStiffness::dyad_ik_jl(&IDENTITY, deformation_gradient)
+ CauchyTangentStiffness::dyad_il_jk(deformation_gradient, &IDENTITY)
- CauchyTangentStiffness::dyad_ij_kl(&IDENTITY, deformation_gradient)
* (TWO_THIRDS))
* scaled_shear_modulus
+ CauchyTangentStiffness::dyad_ij_kl(
&(IDENTITY * (0.5 * self.bulk_modulus() * (jacobian + 1.0 / jacobian))
- scaled_deviatoric_isochoric_left_cauchy_green_deformation
* (FIVE_THIRDS)),
&inverse_transpose_deformation_gradient,
)
+ term,
)
}
}
impl<T> Hyperelastic for EightChain<T>
where
T: SingleChainThermodynamics,
{
#[doc = include_str!("helmholtz_free_energy_density.md")]
fn helmholtz_free_energy_density(
&self,
deformation_gradient: &DeformationGradient,
) -> Result<Scalar, ConstitutiveError> {
let jacobian = self.jacobian(deformation_gradient)?;
let isochoric_left_cauchy_green_deformation =
deformation_gradient.left_cauchy_green() / jacobian.powf(TWO_THIRDS);
let gamma =
(isochoric_left_cauchy_green_deformation.trace() / 3.0 / self.number_of_links()).sqrt();
let eta = self.nondimensional_force(gamma)?;
let gamma_0 = (1.0 / self.number_of_links()).sqrt();
let eta_0 = self.nondimensional_force(gamma_0)?;
Ok(3.0 * gamma_0 / eta_0
* self.shear_modulus()
* self.number_of_links()
* (gamma * eta - gamma_0 * eta_0 - (eta_0 * eta.sinh() / (eta * eta_0.sinh())).ln())
+ 0.5 * self.bulk_modulus() * (0.5 * (jacobian.powi(2) - 1.0) - jacobian.ln()))
}
}