diffsol 0.12.4

A library for solving ordinary differential equations (ODEs) in Rust.
Documentation
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use log::{debug, info, trace};
use std::ops::AddAssign;
use std::{cell::Ref, fmt::Display};

use crate::{
    error::{DiffsolError, OdeSolverError},
    AugmentedOdeEquationsImplicit, Convergence, DefaultDenseMatrix, NoAug, StateRef, StateRefMut,
};

use num_traits::{abs, FromPrimitive, One, Pow, Signed, ToPrimitive, Zero};
use serde::Serialize;

use crate::ode_solver_error;
use crate::{
    matrix::MatrixRef, nonlinear_solver::root::RootFinder, op::bdf::BdfCallable, scalar::scale,
    AugmentedOdeEquations, BdfState, DenseMatrix, JacobianUpdate, MatrixViewMut, NonLinearOp,
    NonLinearSolver, OdeEquationsImplicit, OdeEquationsImplicitAdjoint, OdeEquationsImplicitSens,
    OdeSolverMethod, OdeSolverProblem, OdeSolverState, OdeSolverStopReason, Op, Scalar,
    SensEquations, Vector, VectorRef, VectorView, VectorViewMut,
};

use super::adjoint::AdjointOdeSolverMethod;
use super::config::BdfConfig;
use super::jacobian_update::SolverState;
use super::method::AugmentedOdeSolverMethod;
use super::sensitivities::SensitivitiesOdeSolverMethod;

#[derive(Clone, Debug, Serialize, Default)]
pub struct BdfStatistics {
    pub number_of_linear_solver_setups: usize,
    pub number_of_steps: usize,
    pub number_of_error_test_failures: usize,
    pub number_of_nonlinear_solver_iterations: usize,
    pub number_of_nonlinear_solver_fails: usize,
}

impl Display for BdfStatistics {
    fn fmt(&self, f: &mut std::fmt::Formatter<'_>) -> std::fmt::Result {
        write!(f, "{}", serde_json::to_string_pretty(self).unwrap())
    }
}

impl<'a, M, Eqn, Nls, AugEqn> AugmentedOdeSolverMethod<'a, Eqn, AugEqn>
    for Bdf<'a, Eqn, Nls, M, AugEqn>
where
    Eqn: OdeEquationsImplicit,
    AugEqn: AugmentedOdeEquationsImplicit<Eqn>,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C>,
    for<'b> &'b Eqn::V: VectorRef<Eqn::V>,
    for<'b> &'b Eqn::M: MatrixRef<Eqn::M>,
    Nls: NonLinearSolver<Eqn::M>,
    Eqn::V: DefaultDenseMatrix<T = Eqn::T>,
{
    fn into_state_and_eqn(mut self) -> (Self::State, Option<AugEqn>) {
        let callable = std::mem::take(&mut self.s_op);
        let state = self.into_state();
        (state, callable.map(|op| op.eqn))
    }
    fn augmented_eqn(&self) -> Option<&AugEqn> {
        self.s_op.as_ref().map(|op| op.eqn())
    }
    fn augmented_eqn_mut(&mut self) -> Option<&mut AugEqn> {
        self.s_op.as_mut().map(|op| &mut op.eqn)
    }
}

impl<'a, M, Eqn, Nls> SensitivitiesOdeSolverMethod<'a, Eqn>
    for Bdf<'a, Eqn, Nls, M, SensEquations<'a, Eqn>>
where
    Eqn: OdeEquationsImplicitSens + 'a,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C>,
    for<'b> &'b Eqn::V: VectorRef<Eqn::V>,
    for<'b> &'b Eqn::M: MatrixRef<Eqn::M>,
    Nls: NonLinearSolver<Eqn::M>,
    Eqn::V: DefaultDenseMatrix<T = Eqn::T>,
{
}

impl<'a, M, Eqn, Nls, Solver> AdjointOdeSolverMethod<'a, Eqn, Solver>
    for Bdf<'a, Eqn, Nls, M, crate::AdjointEquations<'a, Eqn, Solver>>
where
    Eqn: OdeEquationsImplicitAdjoint + 'a,
    Solver: OdeSolverMethod<'a, Eqn>,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C>,
    for<'b> &'b Eqn::V: VectorRef<Eqn::V>,
    for<'b> &'b Eqn::M: MatrixRef<Eqn::M>,
    Nls: NonLinearSolver<Eqn::M>,
    Eqn::V: DefaultDenseMatrix<T = Eqn::T>,
{
}

// notes quadrature.
// ndf formula rearranged to [2]:
// (1 - kappa) * gamma_k * (y_{n+1} - y^0_{n+1}) + (\sum_{m=1}^k gamma_m * y^m_n) - h * F(t_{n+1}, y_{n+1}) = 0 (1)
// where d = y_{n+1} - y^0_{n+1}
// and y^0_{n+1} = \sum_{m=0}^k y^m_n
//
// 1. use (1) to calculate d explicitly
// 2. use d to update the differences matrix
// 3. use d to calculate the predicted solution y_{n+1}

/// Implements a Backward Difference formula (BDF) implicit multistep integrator.
///
/// The basic algorithm is derived in \[1\]. This
/// particular implementation follows that implemented in the Matlab routine ode15s
/// described in \[2\] and the SciPy implementation
/// /[3/], which features the NDF formulas for improved
/// stability with associated differences in the error constants, and calculates
/// the jacobian at J(t_{n+1}, y^0_{n+1}). This implementation was based on that
/// implemented in the SciPy library \[3\], which also mainly
/// follows \[2\] but uses the more standard Jacobian update.
///
/// # References
///
/// \[1\] Byrne, G. D., & Hindmarsh, A. C. (1975). A polyalgorithm for the numerical solution of ordinary differential equations. ACM Transactions on Mathematical Software (TOMS), 1(1), 71-96.
/// \[2\] Shampine, L. F., & Reichelt, M. W. (1997). The matlab ode suite. SIAM journal on scientific computing, 18(1), 1-22.
/// \[3\] Virtanen, P., Gommers, R., Oliphant, T. E., Haberland, M., Reddy, T., Cournapeau, D., ... & Van Mulbregt, P. (2020). SciPy 1.0: fundamental algorithms for scientific computing in Python. Nature methods, 17(3), 261-272.
pub struct Bdf<
    'a,
    Eqn: OdeEquationsImplicit,
    Nls: NonLinearSolver<Eqn::M>,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C> = <<Eqn as Op>::V as DefaultDenseMatrix>::M,
    AugmentedEqn: AugmentedOdeEquationsImplicit<Eqn> = NoAug<Eqn>,
> where
    Eqn::V: DefaultDenseMatrix,
{
    nonlinear_solver: Nls,
    convergence: Convergence<'a, Eqn::V>,
    ode_problem: &'a OdeSolverProblem<Eqn>,
    op: Option<BdfCallable<&'a Eqn>>,
    n_equal_steps: usize,
    y_delta: Eqn::V,
    g_delta: Eqn::V,
    y_predict: Eqn::V,
    t_predict: Eqn::T,
    s_predict: Eqn::V,
    s_op: Option<BdfCallable<AugmentedEqn>>,
    s_deltas: Vec<Eqn::V>,
    sg_deltas: Vec<Eqn::V>,
    diff_tmp: M,
    gdiff_tmp: M,
    sgdiff_tmp: M,
    u: M,
    alpha: Vec<Eqn::T>,
    gamma: Vec<Eqn::T>,
    error_const2: Vec<Eqn::T>,
    statistics: BdfStatistics,
    state: BdfState<Eqn::V, M>,
    tstop: Option<Eqn::T>,
    root_finder: Option<RootFinder<Eqn::V>>,
    is_state_modified: bool,
    jacobian_update: JacobianUpdate<Eqn::T>,
    config: BdfConfig<Eqn::T>,
}

impl<M, Eqn, Nls, AugmentedEqn> Clone for Bdf<'_, Eqn, Nls, M, AugmentedEqn>
where
    Eqn: OdeEquationsImplicit,
    Nls: NonLinearSolver<Eqn::M>,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C>,
    AugmentedEqn: AugmentedOdeEquationsImplicit<Eqn>,
    Eqn::V: DefaultDenseMatrix,
{
    fn clone(&self) -> Self {
        let problem = self.ode_problem;
        let mut nonlinear_solver = Nls::default();
        let op = if let Some(op) = self.op.as_ref() {
            let op = op.clone_state(&self.ode_problem.eqn);
            nonlinear_solver.set_problem(&op);
            Some(op)
        } else {
            None
        };
        let s_op = self.s_op.as_ref().map(|op| {
            let op = op.clone_state(op.eqn().clone());
            op
        });
        let mut convergence = self.convergence.clone();
        convergence.reset_eta();
        Self {
            nonlinear_solver,
            ode_problem: problem,
            convergence,
            op,
            s_op,
            n_equal_steps: self.n_equal_steps,
            y_delta: self.y_delta.clone(),
            g_delta: self.g_delta.clone(),
            y_predict: self.y_predict.clone(),
            t_predict: self.t_predict,
            s_predict: self.s_predict.clone(),
            s_deltas: self.s_deltas.clone(),
            sg_deltas: self.sg_deltas.clone(),
            diff_tmp: self.diff_tmp.clone(),
            gdiff_tmp: self.gdiff_tmp.clone(),
            sgdiff_tmp: self.sgdiff_tmp.clone(),
            u: self.u.clone(),
            alpha: self.alpha.clone(),
            gamma: self.gamma.clone(),
            error_const2: self.error_const2.clone(),
            statistics: BdfStatistics::default(),
            state: self.state.clone(),
            tstop: self.tstop,
            root_finder: self.root_finder.clone(),
            is_state_modified: self.is_state_modified,
            jacobian_update: self.jacobian_update.clone(),
            config: self.config.clone(),
        }
    }
}

impl<'a, M, Eqn, Nls, AugmentedEqn> Drop for Bdf<'a, Eqn, Nls, M, AugmentedEqn>
where
    Eqn: OdeEquationsImplicit,
    Nls: NonLinearSolver<Eqn::M>,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C>,
    AugmentedEqn: AugmentedOdeEquationsImplicit<Eqn>,
    Eqn::V: DefaultDenseMatrix,
{
    fn drop(&mut self) {
        info!("BDF Solver Statistics: {}", self.statistics);
    }
}

impl<'a, M, Eqn, Nls, AugmentedEqn> Bdf<'a, Eqn, Nls, M, AugmentedEqn>
where
    AugmentedEqn: AugmentedOdeEquations<Eqn> + OdeEquationsImplicit,
    Eqn: OdeEquationsImplicit,
    Eqn::V: DefaultDenseMatrix,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C>,
    for<'b> &'b Eqn::V: VectorRef<Eqn::V>,
    for<'b> &'b Eqn::M: MatrixRef<Eqn::M>,
    Nls: NonLinearSolver<Eqn::M>,
{
    pub fn new(
        problem: &'a OdeSolverProblem<Eqn>,
        state: BdfState<Eqn::V, M>,
        nonlinear_solver: Nls,
    ) -> Result<Self, DiffsolError> {
        Self::_new(
            problem,
            state,
            nonlinear_solver,
            true,
            BdfConfig::new(&problem.ode_options),
        )
    }

    fn _new(
        problem: &'a OdeSolverProblem<Eqn>,
        mut state: BdfState<Eqn::V, M>,
        mut nonlinear_solver: Nls,
        integrate_main_eqn: bool,
        config: BdfConfig<Eqn::T>,
    ) -> Result<Self, DiffsolError> {
        // kappa values for difference orders, taken from Table 1 of [1]
        let kappa: [Eqn::T; 6] = [
            Eqn::T::zero(),
            <Eqn::T as FromPrimitive>::from_f64(-0.1850).unwrap(),
            -Eqn::T::one() / <Eqn::T as FromPrimitive>::from_f64(9.0).unwrap(),
            <Eqn::T as FromPrimitive>::from_f64(-0.0823).unwrap(),
            <Eqn::T as FromPrimitive>::from_f64(-0.0415).unwrap(),
            Eqn::T::zero(),
        ];
        let mut alpha = vec![Eqn::T::zero()];
        let mut gamma = vec![Eqn::T::zero()];
        let mut error_const2 = vec![Eqn::T::one()];

        let max_order: usize = BdfState::<Eqn::V, M>::MAX_ORDER;

        #[allow(clippy::needless_range_loop)]
        for i in 1..=max_order {
            let i_t = <Eqn::T as FromPrimitive>::from_f64(i as f64).unwrap();
            let one_over_i = Eqn::T::one() / i_t;
            let one_over_i_plus_one = Eqn::T::one() / (i_t + Eqn::T::one());
            gamma.push(gamma[i - 1] + one_over_i);
            alpha.push(Eqn::T::one() / ((Eqn::T::one() - kappa[i]) * gamma[i]));
            let error_const2_i = kappa[i] * gamma[i] + one_over_i_plus_one;
            error_const2.push(error_const2_i * error_const2_i);
        }

        state.check_consistent_with_problem(problem)?;

        let mut convergence = Convergence::with_tolerance(
            problem.rtol,
            &problem.atol,
            problem.ode_options.nonlinear_solver_tolerance,
        );
        convergence.set_max_iter(config.maximum_newton_iterations);

        let op = if integrate_main_eqn {
            // setup linear solver for first step
            let bdf_callable = BdfCallable::new(&problem.eqn);
            bdf_callable.set_c(state.h, alpha[state.order]);
            nonlinear_solver.set_problem(&bdf_callable);
            nonlinear_solver.reset_jacobian(&bdf_callable, &state.y, state.t);
            Some(bdf_callable)
        } else {
            None
        };

        state.set_problem(problem)?;

        // setup root solver
        let mut root_finder = None;
        let ctx = problem.eqn.context();
        if let Some(root_fn) = problem.eqn.root() {
            root_finder = Some(RootFinder::new(
                root_fn.nout(),
                problem.eqn.nstates(),
                ctx.clone(),
            ));
            root_finder
                .as_ref()
                .unwrap()
                .init(&root_fn, &state.y, state.t);
        }

        // (re)allocate internal state
        let nstates = problem.eqn.rhs().nstates();
        let diff_tmp = M::zeros(nstates, BdfState::<Eqn::V, M>::MAX_ORDER + 3, ctx.clone());
        let y_delta = <Eqn::V as Vector>::zeros(nstates, ctx.clone());
        let y_predict = <Eqn::V as Vector>::zeros(nstates, ctx.clone());

        let nout = if problem.integrate_out {
            problem.eqn.nout()
        } else {
            0
        };
        let g_delta = <Eqn::V as Vector>::zeros(nout, ctx.clone());
        let gdiff_tmp = M::zeros(nout, BdfState::<Eqn::V, M>::MAX_ORDER + 3, ctx.clone());

        // init U matrix
        let u = Self::_compute_r(state.order, Eqn::T::one(), ctx.clone());
        let is_state_modified = false;

        Ok(Self {
            convergence,
            s_op: None,
            op,
            ode_problem: problem,
            nonlinear_solver,
            n_equal_steps: 0,
            diff_tmp,
            gdiff_tmp,
            sgdiff_tmp: M::zeros(0, 0, ctx.clone()),
            y_delta,
            y_predict,
            t_predict: Eqn::T::zero(),
            s_predict: Eqn::V::zeros(0, ctx.clone()),
            s_deltas: Vec::new(),
            sg_deltas: Vec::new(),
            g_delta,
            gamma,
            alpha,
            error_const2,
            u,
            statistics: BdfStatistics::default(),
            state,
            tstop: None,
            root_finder,
            is_state_modified,
            jacobian_update: JacobianUpdate::new(&problem.ode_options),
            config,
        })
    }

    pub fn new_augmented(
        state: BdfState<Eqn::V, M>,
        problem: &'a OdeSolverProblem<Eqn>,
        augmented_eqn: AugmentedEqn,
        nonlinear_solver: Nls,
    ) -> Result<Self, DiffsolError> {
        Self::new_augmented_with_config(
            state,
            problem,
            augmented_eqn,
            nonlinear_solver,
            BdfConfig::new(&problem.ode_options),
        )
    }

    pub fn new_augmented_with_config(
        state: BdfState<Eqn::V, M>,
        problem: &'a OdeSolverProblem<Eqn>,
        augmented_eqn: AugmentedEqn,
        nonlinear_solver: Nls,
        config: BdfConfig<Eqn::T>,
    ) -> Result<Self, DiffsolError> {
        state.check_sens_consistent_with_problem(problem, &augmented_eqn)?;

        let mut ret = Self::_new(
            problem,
            state,
            nonlinear_solver,
            augmented_eqn.integrate_main_eqn(),
            config,
        )?;

        ret.state.set_augmented_problem(problem, &augmented_eqn)?;

        // allocate internal state for sensitivities
        let naug = augmented_eqn.max_index();
        let nstates = problem.eqn.rhs().nstates();

        ret.s_op = if augmented_eqn.integrate_main_eqn() {
            Some(BdfCallable::new_no_jacobian(augmented_eqn))
        } else {
            let bdf_callable = BdfCallable::new(augmented_eqn);
            bdf_callable.set_c(ret.state.h, ret.alpha[ret.state.order]);
            ret.nonlinear_solver.set_problem(&bdf_callable);
            ret.nonlinear_solver
                .reset_jacobian(&bdf_callable, &ret.state.s[0], ret.state.t);
            Some(bdf_callable)
        };

        let ctx = problem.eqn.context();
        ret.s_deltas = vec![<Eqn::V as Vector>::zeros(nstates, ctx.clone()); naug];
        ret.s_predict = <Eqn::V as Vector>::zeros(nstates, ctx.clone());
        if let Some(out) = ret.s_op.as_ref().unwrap().eqn().out() {
            ret.sg_deltas = vec![<Eqn::V as Vector>::zeros(out.nout(), ctx.clone()); naug];
            ret.sgdiff_tmp = M::zeros(
                out.nout(),
                BdfState::<Eqn::V, M>::MAX_ORDER + 3,
                ctx.clone(),
            );
        }
        Ok(ret)
    }

    pub fn get_statistics(&self) -> &BdfStatistics {
        &self.statistics
    }

    fn _compute_r(order: usize, factor: Eqn::T, ctx: M::C) -> M {
        //computes the R matrix with entries
        //given by the first equation on page 8 of [1]
        //
        //This is used to update the differences matrix when step size h is varied
        //according to factor = h_{n+1} / h_n
        //
        //Note that the U matrix also defined in the same section can be also be
        //found using factor = 1, which corresponds to R with a constant step size
        let ncols = order + 1;
        let nrows = order + 1;
        let mut r = vec![M::T::zero(); ncols * nrows];

        // r[0, 0:order] = 1
        for j in 0..ncols {
            r[j * nrows] = M::T::one();
        }

        // r[i, j] = r[i-1, j] * (j - 1 - factor * i) / j
        for j in 1..ncols {
            let j_t = <M::T as FromPrimitive>::from_f64(j as f64).unwrap();
            for i in 1..nrows {
                let i_t = <M::T as FromPrimitive>::from_f64(i as f64).unwrap();
                let idx_ij = j * nrows + i;
                r[idx_ij] = r[idx_ij - 1] * (i_t - M::T::one() - factor * j_t) / i_t;
            }
        }

        M::from_vec(order + 1, order + 1, r, ctx)
    }

    fn _jacobian_updates(&mut self, c: Eqn::T, state: SolverState) {
        if self.jacobian_update.check_rhs_jacobian_update(c, &state) {
            if let Some(op) = self.op.as_mut() {
                op.set_jacobian_is_stale();
                self.nonlinear_solver
                    .reset_jacobian(op, &self.state.y, self.state.t);
            } else if let Some(s_op) = self.s_op.as_mut() {
                s_op.set_jacobian_is_stale();
                self.nonlinear_solver
                    .reset_jacobian(s_op, &self.state.s[0], self.state.t);
            }
            self.jacobian_update.update_rhs_jacobian(c);
            self.jacobian_update.update_jacobian(c);
            self.convergence.reset_eta();
        } else if self.jacobian_update.check_jacobian_update(c, &state) {
            if let Some(op) = self.op.as_mut() {
                self.nonlinear_solver
                    .reset_jacobian(op, &self.state.y, self.state.t);
            } else if let Some(s_op) = self.s_op.as_mut() {
                self.nonlinear_solver
                    .reset_jacobian(s_op, &self.state.s[0], self.state.t);
            }
            self.jacobian_update.update_jacobian(c);
            self.convergence.reset_eta();
        }
    }

    fn _update_step_size(&mut self, factor: Eqn::T) -> Result<Eqn::T, DiffsolError> {
        //If step size h is changed then also need to update the terms in
        //the first equation of page 9 of [1]:
        //
        //- constant c = h / (1-kappa) gamma_k term
        //- lu factorisation of (M - c * J) used in newton iteration (same equation)

        let new_h = factor * self.state.h;
        self.n_equal_steps = 0;

        // update D using equations in section 3.2 of [1]
        let order = self.state.order;
        let r = Self::_compute_r(order, factor, self.problem().eqn.context().clone());
        let ru = r.mat_mul(&self.u);
        {
            if self.op.is_some() {
                Self::_update_diff_for_step_size(
                    &ru,
                    &mut self.state.diff,
                    &mut self.diff_tmp,
                    order,
                );
                if self.ode_problem.integrate_out {
                    Self::_update_diff_for_step_size(
                        &ru,
                        &mut self.state.gdiff,
                        &mut self.gdiff_tmp,
                        order,
                    );
                }
            }
            for diff in self.state.sdiff.iter_mut() {
                Self::_update_diff_for_step_size(&ru, diff, &mut self.diff_tmp, order);
            }

            for diff in self.state.sgdiff.iter_mut() {
                Self::_update_diff_for_step_size(&ru, diff, &mut self.sgdiff_tmp, order);
            }
        }

        if let Some(op) = self.op.as_mut() {
            op.set_c(new_h, self.alpha[order]);
        }
        if let Some(s_op) = self.s_op.as_mut() {
            s_op.set_c(new_h, self.alpha[order]);
        }

        self.state.h = new_h;
        self.convergence.reset_eta_timestep_change();

        // if step size too small, then fail
        if self.state.h.abs() < self.config.minimum_timestep {
            return Err(DiffsolError::from(OdeSolverError::StepSizeTooSmall {
                time: self.state.t.to_f64().unwrap(),
            }));
        }

        Ok(new_h)
    }

    fn _update_diff_for_step_size(ru: &M, diff: &mut M, diff_tmp: &mut M, order: usize) {
        // D[0:order+1] = R * U * D[0:order+1]
        {
            let d_zero_order = diff.columns(0, order + 1);
            let mut d_zero_order_tmp = diff_tmp.columns_mut(0, order + 1);
            d_zero_order_tmp.gemm_vo(Eqn::T::one(), &d_zero_order, ru, Eqn::T::zero());
            // diff_sub = diff * RU
        }
        std::mem::swap(diff, diff_tmp);
    }

    fn calculate_output_delta(&mut self) {
        // integrate output function
        let state = &mut self.state;
        let out = self.ode_problem.eqn.out().unwrap();
        out.call_inplace(&self.y_predict, self.t_predict, &mut state.dg);
        self.op.as_ref().unwrap().integrate_out(
            &state.dg,
            &state.gdiff,
            self.gamma.as_slice(),
            self.alpha.as_slice(),
            state.order,
            &mut self.g_delta,
        );
    }

    fn calculate_sens_output_delta(&mut self, i: usize) {
        let state = &mut self.state;
        let s_op = self.s_op.as_ref().unwrap();

        // integrate sensitivity output equations
        let out = s_op.eqn().out().unwrap();
        out.call_inplace(&state.s[i], self.t_predict, &mut state.dsg[i]);

        if let Some(op) = self.s_op.as_ref() {
            op.integrate_out(
                &state.dsg[i],
                &state.sgdiff[i],
                self.gamma.as_slice(),
                self.alpha.as_slice(),
                state.order,
                &mut self.sg_deltas[i],
            );
        } else if let Some(s_op) = self.s_op.as_ref() {
            s_op.integrate_out(
                &state.dsg[i],
                &state.sgdiff[i],
                self.gamma.as_slice(),
                self.alpha.as_slice(),
                state.order,
                &mut self.sg_deltas[i],
            );
        }
    }

    fn update_differences_and_integrate_out(&mut self) {
        let order = self.state.order;
        let state = &mut self.state;

        // update differences
        Self::_update_diff(order, &self.y_delta, &mut state.diff);

        // integrate output function
        if self.ode_problem.integrate_out {
            Self::_predict_using_diff(&mut state.g, &state.gdiff, order);
            state.g.axpy(Eqn::T::one(), &self.g_delta, Eqn::T::one());

            // update output difference
            Self::_update_diff(order, &self.g_delta, &mut state.gdiff);
        }

        // do the same for sensitivities
        if let Some(s_op) = self.s_op.as_ref() {
            for i in 0..s_op.eqn().max_index() {
                // update sensitivity differences
                Self::_update_diff(order, &self.s_deltas[i], &mut state.sdiff[i]);

                // integrate sensitivity output equations
                if s_op.eqn().out().is_some() {
                    Self::_predict_using_diff(&mut state.sg[i], &state.sgdiff[i], order);
                    state.sg[i].axpy(Eqn::T::one(), &self.sg_deltas[i], Eqn::T::one());

                    // update sensitivity output difference
                    Self::_update_diff(order, &self.sg_deltas[i], &mut state.sgdiff[i]);
                }
            }
        }
    }

    fn _update_diff(order: usize, d: &Eqn::V, diff: &mut M) {
        //update of difference equations can be done efficiently
        //by reusing d and D.
        //
        //From first equation on page 4 of [1]:
        //d = y_n - y^0_n = D^{k + 1} y_n
        //
        //Standard backwards difference gives
        //D^{j + 1} y_n = D^{j} y_n - D^{j} y_{n - 1}
        //
        //Combining these gives the following algorithm
        let d_minus_order_plus_one = d - diff.column(order + 1);
        diff.column_mut(order + 2)
            .copy_from(&d_minus_order_plus_one);
        diff.column_mut(order + 1).copy_from(d);
        for i in (0..=order).rev() {
            diff.column_axpy(Eqn::T::one(), i + 1, i);
        }
    }

    // predict forward to new step (eq 2 in [1])
    fn _predict_using_diff(y_predict: &mut Eqn::V, diff: &M, order: usize) {
        y_predict.fill(Eqn::T::zero());
        for i in 0..=order {
            y_predict.add_assign(diff.column(i));
        }
    }

    fn _predict_forward(&mut self) {
        let state = &self.state;
        Self::_predict_using_diff(&mut self.y_predict, &state.diff, state.order);

        // update psi and c (h, D, y0 has changed)
        if let Some(op) = self.op.as_mut() {
            op.set_psi_and_y0(
                &state.diff,
                self.gamma.as_slice(),
                self.alpha.as_slice(),
                state.order,
                &self.y_predict,
            );
        }

        // update time
        let t_new = state.t + state.h;
        self.t_predict = t_new;
    }

    fn handle_tstop(
        &mut self,
        tstop: Eqn::T,
    ) -> Result<Option<OdeSolverStopReason<Eqn::T>>, DiffsolError> {
        // check if the we are at tstop
        let state = &self.state;
        let troundoff = <Eqn::T as FromPrimitive>::from_f64(100.0).unwrap()
            * Eqn::T::EPSILON
            * (abs(state.t) + abs(state.h));
        if abs(state.t - tstop) <= troundoff {
            self.tstop = None;
            return Ok(Some(OdeSolverStopReason::TstopReached));
        } else if (state.h > M::T::zero() && tstop < state.t - troundoff)
            || (state.h < M::T::zero() && tstop > state.t + troundoff)
        {
            let error = OdeSolverError::StopTimeBeforeCurrentTime {
                stop_time: self.tstop.unwrap().to_f64().unwrap(),
                state_time: state.t.to_f64().unwrap(),
            };
            self.tstop = None;

            return Err(DiffsolError::from(error));
        }

        // check if the next step will be beyond tstop, if so adjust the step size
        if (state.h > M::T::zero() && state.t + state.h > tstop + troundoff)
            || (state.h < M::T::zero() && state.t + state.h < tstop - troundoff)
        {
            debug!(
                "Adjusting step size to hit tstop at t = {}",
                tstop.to_f64().unwrap()
            );
            let factor = (tstop - state.t) / state.h;
            // update step size ignoring the possible "step size too small" error
            let _ = self._update_step_size(factor);
        }
        Ok(None)
    }

    fn initialise_to_first_order(&mut self) {
        self.n_equal_steps = 0;

        // scale step size h to account for reduction in order at order n error is O(h^{n+2}))
        // error_b = C * h_old^{n+2}
        // error_a = C * h_new^{3}
        // set error_a = error_b
        // => h_new = h_old^{(n+2)/3}
        //let sign_h = if self.state.h >= Eqn::T::zero() {
        //    Eqn::T::one()
        //} else {
        //    -Eqn::T::one()
        //};
        //self.state.h = sign_h * self.state.h.abs().powf(M::T::from_f64((self.state.order + 2) as f64 / 3.0).unwrap());

        self.state.initialise_diff_to_first_order();

        if self.ode_problem.integrate_out {
            self.state.initialise_gdiff_to_first_order();
        }
        if let Some(s_op) = self.s_op.as_ref() {
            self.state.initialise_sdiff_to_first_order();
            if s_op.eqn().out().is_some() {
                self.state.initialise_sgdiff_to_first_order();
            }
        }

        self.u = Self::_compute_r(1, Eqn::T::one(), self.problem().eqn.context().clone());

        self.is_state_modified = false;
    }

    //interpolate solution at time values t* where t-h < t* < t
    //definition of the interpolating polynomial can be found on page 7 of [1]
    fn interpolate_from_diff(
        t: Eqn::T,
        diff: &M,
        t1: Eqn::T,
        h: Eqn::T,
        order: usize,
        y: &mut Eqn::V,
    ) {
        let mut time_factor = Eqn::T::one();
        y.copy_from_view(&diff.column(0));
        for i in 0..order {
            let i_t = <Eqn::T as FromPrimitive>::from_f64(i as f64).unwrap();
            time_factor *= (t - (t1 - h * i_t)) / (h * (Eqn::T::one() + i_t));
            y.axpy_v(time_factor, &diff.column(i + 1), Eqn::T::one());
        }
    }

    // Interpolate the time derivative dy/dt of the BDF polynomial at time t.
    // Uses the product-rule differentiation of the interpolating polynomial from page 7 of [1].
    // For each term pi_i(t) = prod_{j=0}^{i-1} (t - (t1 - j*h)) / ((j+1)*h),
    // we maintain pi (the product) and d_pi (its derivative) iteratively.
    fn interpolate_derivative_from_diff(
        t: Eqn::T,
        diff: &M,
        t1: Eqn::T,
        h: Eqn::T,
        order: usize,
        dy: &mut Eqn::V,
    ) {
        let mut pi = Eqn::T::one();
        let mut d_pi = Eqn::T::zero();
        dy.fill(Eqn::T::zero());
        for i in 0..order {
            let i_t = <Eqn::T as FromPrimitive>::from_f64(i as f64).unwrap();
            let denom = h * (Eqn::T::one() + i_t);
            let w = (t - (t1 - h * i_t)) / denom;
            let dw = Eqn::T::one() / denom;
            // d(pi_{i+1})/dt = d(pi_i)/dt * w + pi_i * dw
            let new_d_pi = d_pi * w + pi * dw;
            pi *= w;
            d_pi = new_d_pi;
            dy.axpy_v(d_pi, &diff.column(i + 1), Eqn::T::one());
        }
    }

    fn error_control(&self) -> Eqn::T {
        let state = &self.state;
        let order = state.order;
        let output_in_error_control = self.ode_problem.output_in_error_control();
        let integrate_sens = self.s_op.is_some();
        let sens_in_error_control =
            integrate_sens && self.s_op.as_ref().unwrap().eqn().include_in_error_control();
        let integrate_sens_out =
            integrate_sens && self.s_op.as_ref().unwrap().eqn().out().is_some();
        let sens_output_in_error_control = integrate_sens_out
            && self
                .s_op
                .as_ref()
                .unwrap()
                .eqn()
                .include_out_in_error_control();

        let mut error_norm = M::T::zero();
        let mut ncontrib = 0;
        if self.op.is_some() {
            let atol = &self.ode_problem.atol;
            let rtol = self.ode_problem.rtol;
            error_norm +=
                self.y_delta.squared_norm(&state.y, atol, rtol) * self.error_const2[order - 1];
            ncontrib += 1;
            if output_in_error_control {
                let rtol = self.ode_problem.out_rtol.unwrap();
                let atol = self.ode_problem.out_atol.as_ref().unwrap();
                error_norm +=
                    self.g_delta.squared_norm(&state.g, atol, rtol) * self.error_const2[order];
                ncontrib += 1;
            }
        }
        if sens_in_error_control {
            let sens_atol = self.s_op.as_ref().unwrap().eqn().atol().unwrap();
            let sens_rtol = self.s_op.as_ref().unwrap().eqn().rtol().unwrap();
            for i in 0..state.sdiff.len() {
                error_norm += self.s_deltas[i].squared_norm(&state.s[i], sens_atol, sens_rtol)
                    * self.error_const2[order];
            }
            ncontrib += state.sdiff.len();
        }
        if sens_output_in_error_control {
            let rtol = self.s_op.as_ref().unwrap().eqn().out_rtol().unwrap();
            let atol = self.s_op.as_ref().unwrap().eqn().out_atol().unwrap();
            for i in 0..state.sgdiff.len() {
                error_norm += self.sg_deltas[i].squared_norm(&state.sg[i], atol, rtol)
                    * self.error_const2[order];
            }
            ncontrib += state.sgdiff.len();
        }
        if ncontrib > 1 {
            error_norm /= <Eqn::T as FromPrimitive>::from_f64(ncontrib as f64).unwrap()
        }
        error_norm
    }

    fn predict_error_control(&self, order: usize) -> Eqn::T {
        let state = &self.state;
        let output_in_error_control = self.ode_problem.output_in_error_control();
        let integrate_sens = self.s_op.is_some();
        let sens_in_error_control =
            integrate_sens && self.s_op.as_ref().unwrap().eqn().include_in_error_control();
        let integrate_sens_out =
            integrate_sens && self.s_op.as_ref().unwrap().eqn().out().is_some();
        let sens_output_in_error_control = integrate_sens_out
            && self
                .s_op
                .as_ref()
                .unwrap()
                .eqn()
                .include_out_in_error_control();

        let atol = &self.ode_problem.atol;
        let rtol = self.ode_problem.rtol;
        let mut error_norm = M::T::zero();
        let mut ncontrib = 0;
        if self.op.is_some() {
            error_norm += state
                .diff
                .column(order + 1)
                .squared_norm(&state.y, atol, rtol)
                * self.error_const2[order];
            ncontrib += 1;
            if output_in_error_control {
                let rtol = self.ode_problem.out_rtol.unwrap();
                let atol = self.ode_problem.out_atol.as_ref().unwrap();
                error_norm += state
                    .gdiff
                    .column(order + 1)
                    .squared_norm(&state.g, atol, rtol)
                    * self.error_const2[order];
                ncontrib += 1;
            }
        }
        if sens_in_error_control {
            let sens_atol = self.s_op.as_ref().unwrap().eqn().atol().unwrap();
            let sens_rtol = self.s_op.as_ref().unwrap().eqn().rtol().unwrap();
            for i in 0..state.sdiff.len() {
                error_norm += state.sdiff[i].column(order + 1).squared_norm(
                    &state.s[i],
                    sens_atol,
                    sens_rtol,
                ) * self.error_const2[order];
            }
            ncontrib += state.sdiff.len();
        }
        if sens_output_in_error_control {
            let rtol = self.s_op.as_ref().unwrap().eqn().out_rtol().unwrap();
            let atol = self.s_op.as_ref().unwrap().eqn().out_atol().unwrap();
            for i in 0..state.sgdiff.len() {
                error_norm +=
                    state.sgdiff[i]
                        .column(order + 1)
                        .squared_norm(&state.sg[i], atol, rtol)
                        * self.error_const2[order];
            }
            ncontrib += state.sgdiff.len();
        }
        if ncontrib == 0 {
            error_norm
        } else {
            error_norm / <Eqn::T as FromPrimitive>::from_f64(ncontrib as f64).unwrap()
        }
    }

    fn sensitivity_solve(&mut self, t_new: Eqn::T) -> Result<(), DiffsolError> {
        let order = self.state.order;

        // update for new state
        if let Some(op) = self.op.as_ref() {
            let s_op = self.s_op.as_mut().unwrap();
            let dy_new = op.tmp();
            let y_new = &self.y_predict;
            s_op.eqn_mut().update_rhs_out_state(y_new, &dy_new, t_new);
        }

        // solve for sensitivities equations discretised using BDF
        let naug = self.s_op.as_mut().unwrap().eqn().max_index();
        for i in 0..naug {
            // setup
            let s_op = self.s_op.as_mut().unwrap();
            {
                let state = &self.state;
                // predict forward to new step
                Self::_predict_using_diff(&mut self.s_predict, &state.sdiff[i], order);

                // setup op
                s_op.set_psi_and_y0(
                    &state.sdiff[i],
                    self.gamma.as_slice(),
                    self.alpha.as_slice(),
                    order,
                    &self.s_predict,
                );
                s_op.eqn_mut().set_index(i);
            }

            // solve
            {
                let s_new = &mut self.state.s[i];
                s_new.copy_from(&self.s_predict);
                trace!("Solving sensitivity equation index {}", i);
                self.nonlinear_solver.solve_in_place(
                    &*s_op,
                    s_new,
                    t_new,
                    &self.s_predict,
                    &mut self.convergence,
                )?;
                self.statistics.number_of_nonlinear_solver_iterations += self.convergence.niter();
                let s_new = &*s_new;
                self.s_deltas[i].copy_from(s_new);
                self.s_deltas[i] -= &self.s_predict;
            }

            if s_op.eqn().out().is_some() && s_op.eqn().include_out_in_error_control() {
                self.calculate_sens_output_delta(i);
            }
        }
        Ok(())
    }
}

impl<'a, M, Eqn, Nls, AugmentedEqn> OdeSolverMethod<'a, Eqn> for Bdf<'a, Eqn, Nls, M, AugmentedEqn>
where
    Eqn: OdeEquationsImplicit,
    AugmentedEqn: AugmentedOdeEquations<Eqn> + OdeEquationsImplicit,
    M: DenseMatrix<T = Eqn::T, V = Eqn::V, C = Eqn::C>,
    Eqn::V: DefaultDenseMatrix,
    Nls: NonLinearSolver<Eqn::M>,
    for<'b> &'b Eqn::V: VectorRef<Eqn::V>,
    for<'b> &'b Eqn::M: MatrixRef<Eqn::M>,
{
    type State = BdfState<Eqn::V, M>;
    type Config = BdfConfig<Eqn::T>;

    fn config(&self) -> &BdfConfig<Eqn::T> {
        &self.config
    }

    fn config_mut(&mut self) -> &mut BdfConfig<Eqn::T> {
        &mut self.config
    }

    fn order(&self) -> usize {
        self.state.order
    }

    fn jacobian(&self) -> Option<Ref<'_, <Eqn>::M>> {
        let t = self.state.t;
        if let Some(op) = self.op.as_ref() {
            let x = &self.state.y;
            Some(op.rhs_jac(x, t))
        } else {
            let x = &self.state.s[0];
            self.s_op.as_ref().map(|s_op| s_op.rhs_jac(x, t))
        }
    }

    fn mass(&self) -> Option<Ref<'_, <Eqn>::M>> {
        let t = self.state.t;
        if let Some(op) = self.op.as_ref() {
            Some(op.mass(t))
        } else {
            self.s_op.as_ref().map(|s_op| s_op.mass(t))
        }
    }

    fn set_state(&mut self, state: Self::State) {
        debug!(
            "Manually setting BDF state, step size = {}, order = {}, time = {}",
            state.h, state.order, state.t
        );
        let old_order = self.state.order;
        self.state = state;

        if let Some(op) = self.op.as_mut() {
            op.set_c(self.state.h, self.alpha[self.state.order]);
        }

        // order might have changed
        if self.state.order != old_order {
            self.u = Self::_compute_r(
                self.state.order,
                Eqn::T::one(),
                self.problem().eqn.context().clone(),
            );
        }

        // reinitialise jacobian updates as if a checkpoint was taken
        self._jacobian_updates(
            self.state.h * self.alpha[self.state.order],
            SolverState::Checkpoint,
        );
    }

    fn interpolate_inplace(&self, t: Eqn::T, y: &mut Eqn::V) -> Result<(), DiffsolError> {
        if y.len() != self.state.y.len() {
            return Err(DiffsolError::from(
                OdeSolverError::InterpolationVectorWrongSize {
                    expected: self.state.y.len(),
                    found: y.len(),
                },
            ));
        }
        // state must be set
        let state = &self.state;
        if self.is_state_modified {
            if t == state.t {
                y.copy_from(&state.y);
                return Ok(());
            } else {
                return Err(ode_solver_error!(InterpolationTimeOutsideCurrentStep));
            }
        }
        // check that t is before/after the current time depending on the direction
        let is_forward = state.h > Eqn::T::zero();
        if (is_forward && t > state.t) || (!is_forward && t < state.t) {
            return Err(ode_solver_error!(InterpolationTimeAfterCurrentTime));
        }
        Self::interpolate_from_diff(t, &state.diff, state.t, state.h, state.order, y);
        Ok(())
    }

    fn interpolate_dy_inplace(&self, t: Eqn::T, dy: &mut Eqn::V) -> Result<(), DiffsolError> {
        if dy.len() != self.state.y.len() {
            return Err(DiffsolError::from(
                OdeSolverError::InterpolationVectorWrongSize {
                    expected: self.state.y.len(),
                    found: dy.len(),
                },
            ));
        }
        let state = &self.state;
        if self.is_state_modified {
            if t == state.t {
                dy.copy_from(&state.dy);
                return Ok(());
            } else {
                return Err(ode_solver_error!(InterpolationTimeOutsideCurrentStep));
            }
        }
        let is_forward = state.h > Eqn::T::zero();
        if (is_forward && t > state.t) || (!is_forward && t < state.t) {
            return Err(ode_solver_error!(InterpolationTimeAfterCurrentTime));
        }
        Self::interpolate_derivative_from_diff(t, &state.diff, state.t, state.h, state.order, dy);
        Ok(())
    }

    fn interpolate_out_inplace(&self, t: Eqn::T, g: &mut Eqn::V) -> Result<(), DiffsolError> {
        if g.len() != self.state.g.len() {
            return Err(DiffsolError::from(
                OdeSolverError::InterpolationVectorWrongSize {
                    expected: self.state.g.len(),
                    found: g.len(),
                },
            ));
        }
        // state must be set
        let state = &self.state;
        if self.is_state_modified {
            if t == state.t {
                g.copy_from(&state.g);
                return Ok(());
            } else {
                return Err(ode_solver_error!(InterpolationTimeOutsideCurrentStep));
            }
        }
        // check that t is before/after the current time depending on the direction
        let is_forward = state.h > Eqn::T::zero();
        if (is_forward && t > state.t) || (!is_forward && t < state.t) {
            return Err(ode_solver_error!(InterpolationTimeAfterCurrentTime));
        }
        Self::interpolate_from_diff(t, &state.gdiff, state.t, state.h, state.order, g);
        Ok(())
    }

    fn interpolate_sens_inplace(
        &self,
        t: <Eqn as Op>::T,
        sens: &mut [Eqn::V],
    ) -> Result<(), DiffsolError> {
        if sens.len() != self.state.sdiff.len() {
            return Err(DiffsolError::from(
                OdeSolverError::SensitivityCountMismatch {
                    expected: self.state.sdiff.len(),
                    found: sens.len(),
                },
            ));
        }
        for s in sens.iter() {
            if s.len() != self.state.s[0].len() {
                return Err(DiffsolError::from(
                    OdeSolverError::InterpolationVectorWrongSize {
                        expected: self.state.s[0].len(),
                        found: s.len(),
                    },
                ));
            }
        }

        // state must be set
        let state = &self.state;
        if self.is_state_modified {
            if t == state.t {
                for (s, st) in sens.iter_mut().zip(state.s.iter()) {
                    s.copy_from(st);
                }
                return Ok(());
            } else {
                return Err(ode_solver_error!(InterpolationTimeOutsideCurrentStep));
            }
        }
        // check that t is before/after the current time depending on the direction
        let is_forward = state.h > Eqn::T::zero();
        if (is_forward && t > state.t) || (!is_forward && t < state.t) {
            return Err(ode_solver_error!(InterpolationTimeAfterCurrentTime));
        }

        for (s, sdiff) in sens.iter_mut().zip(state.sdiff.iter()) {
            Self::interpolate_from_diff(t, sdiff, state.t, state.h, state.order, s);
        }
        Ok(())
    }

    fn problem(&self) -> &'a OdeSolverProblem<Eqn> {
        self.ode_problem
    }

    fn state(&self) -> StateRef<'_, Eqn::V> {
        self.state.as_ref()
    }

    fn into_state(mut self) -> BdfState<Eqn::V, M> {
        let ctx = self.problem().eqn.context().clone();
        std::mem::replace(&mut self.state, BdfState::new_empty(ctx))
    }

    fn state_mut(&mut self) -> StateRefMut<'_, Eqn::V> {
        self.is_state_modified = true;
        self.state.as_mut()
    }

    fn state_mut_back(&mut self, t: Eqn::T) -> Result<(), DiffsolError> {
        let state = &mut self.state;
        if self.is_state_modified {
            if t != state.t {
                return Err(ode_solver_error!(InterpolationTimeOutsideCurrentStep));
            }
            // already at the requested time, nothing to do
            return Ok(());
        }
        let is_forward = state.h > Eqn::T::zero();
        if (is_forward && t > state.t) || (!is_forward && t < state.t) {
            return Err(ode_solver_error!(InterpolationTimeAfterCurrentTime));
        }
        let current_t = state.t;
        let current_h = state.h;
        let order = state.order;
        Self::interpolate_from_diff(t, &state.diff, current_t, current_h, order, &mut state.y);
        Self::interpolate_derivative_from_diff(
            t,
            &state.diff,
            current_t,
            current_h,
            order,
            &mut state.dy,
        );
        if self.ode_problem.integrate_out {
            Self::interpolate_from_diff(t, &state.gdiff, current_t, current_h, order, &mut state.g);
        }
        for (s, sdiff) in state.s.iter_mut().zip(state.sdiff.iter()) {
            Self::interpolate_from_diff(t, sdiff, current_t, current_h, order, s);
        }
        state.t = t;
        self.is_state_modified = true;
        Ok(())
    }

    fn checkpoint(&mut self) -> Self::State {
        debug!("Taking checkpoint");
        self._jacobian_updates(
            self.state.h * self.alpha[self.state.order],
            SolverState::Checkpoint,
        );
        self.state.clone()
    }

    fn state_clone(&self) -> Self::State {
        self.state.clone()
    }

    fn step(&mut self) -> Result<OdeSolverStopReason<Eqn::T>, DiffsolError> {
        debug!(
            "Taking BDF step at time {} with step size {} and order {}",
            self.state.t, self.state.h, self.state.order
        );
        let mut safety: Eqn::T;
        let mut error_norm: Eqn::T;
        let problem = self.ode_problem;
        let integrate_out = problem.integrate_out;
        let output_in_error_control = problem.output_in_error_control();
        let integrate_sens = self.s_op.is_some();
        let old_num_error_test_failures = self.statistics.number_of_error_test_failures;

        let mut convergence_fail = false;

        if self.is_state_modified {
            // reinitalise root finder if needed
            if let Some(root_fn) = problem.eqn.root() {
                let state = &self.state;
                self.root_finder
                    .as_ref()
                    .unwrap()
                    .init(&root_fn, &state.y, state.t);
            }
            // reinitialise diff matrix
            self.initialise_to_first_order();

            // reinitialise tstop if needed
            if let Some(t_stop) = self.tstop {
                self.set_stop_time(t_stop)?;
            }
            debug!(
                "State was modified, reinitialised to first order with h = {}",
                self.state.h
            );
        }

        self._predict_forward();

        // loop until step is accepted
        loop {
            let order = self.state.order;
            self.y_delta.copy_from(&self.y_predict);

            // solve BDF equation using y0 as starting point
            let mut solve_result = Ok(());
            if let Some(op) = self.op.as_ref() {
                solve_result = self.nonlinear_solver.solve_in_place(
                    op,
                    &mut self.y_delta,
                    self.t_predict,
                    &self.y_predict,
                    &mut self.convergence,
                );
                // update statistics
                self.statistics.number_of_nonlinear_solver_iterations += self.convergence.niter();

                if solve_result.is_ok() {
                    // test error is within tolerance
                    // combine eq 3, 4 and 6 from [1] to obtain error
                    // Note that error = C_k * h^{k+1} y^{k+1}
                    // and d = D^{k+1} y_{n+1} \approx h^{k+1} y^{k+1}
                    self.y_delta -= &self.y_predict;

                    // deal with output equations
                    if integrate_out && output_in_error_control {
                        self.calculate_output_delta();
                    }
                }
            }

            // only calculate sensitivities if solve was successful
            if solve_result.is_ok()
                && integrate_sens
                && self.sensitivity_solve(self.t_predict).is_err()
            {
                solve_result = Err(ode_solver_error!(SensitivitySolveFailed));
            }

            // handle case where either nonlinear solve failed
            if solve_result.is_err() {
                self.statistics.number_of_nonlinear_solver_fails += 1;
                if self.statistics.number_of_nonlinear_solver_fails
                    > self.config.maximum_newton_fails
                {
                    return Err(DiffsolError::from(
                        OdeSolverError::TooManyNonlinearSolverFailures {
                            time: self.state.t.to_f64().unwrap(),
                            num_failures: self.statistics.number_of_nonlinear_solver_fails,
                        },
                    ));
                }
                if convergence_fail {
                    // newton iteration did not converge, but jacobian has already been
                    // evaluated so reduce step size by 0.3 (as per [1]) and try again
                    let new_h =
                        self._update_step_size(<Eqn::T as FromPrimitive>::from_f64(0.3).unwrap())?;
                    debug!(
                        "Second convergence failure, reducing step size to {:.3e} and trying again",
                        new_h.to_f64().unwrap()
                    );
                    self._jacobian_updates(
                        new_h * self.alpha[order],
                        SolverState::SecondConvergenceFail,
                    );

                    // new prediction
                    self._predict_forward();

                    // update statistics
                } else {
                    // newton iteration did not converge, so update jacobian and try again
                    debug!("First convergence failure, updating Jacobian and trying again",);
                    self._jacobian_updates(
                        self.state.h * self.alpha[order],
                        SolverState::FirstConvergenceFail,
                    );
                    convergence_fail = true;
                    // same prediction as last time
                }
                continue;
            }

            error_norm = self.error_control();

            // need to caulate safety even if step is accepted
            let maxiter = self.convergence.max_iter() as f64;
            let niter = self.convergence.niter() as f64;
            safety = <Eqn::T as FromPrimitive>::from_f64(
                0.9 * (2.0 * maxiter + 1.0) / (2.0 * maxiter + niter),
            )
            .unwrap();

            // do the error test
            if error_norm <= Eqn::T::one() {
                // step is accepted
                debug!(
                    "Step accepted with error norm {:.3e}",
                    error_norm.to_f64().unwrap()
                );
                break;
            } else {
                // step is rejected
                // calculate optimal step size factor as per eq 2.46 of [2]
                // and reduce step size and try again
                let mut factor = safety
                    * error_norm.pow(
                        <Eqn::T as FromPrimitive>::from_f64(-0.5 / (order as f64 + 1.0)).unwrap(),
                    );
                if factor < self.config.minimum_timestep_shrink {
                    factor = self.config.minimum_timestep_shrink;
                }
                debug!(
                    "Step rejected with error norm {:.3e}, reducing step size by factor {:.3e}",
                    error_norm.to_f64().unwrap(),
                    factor.to_f64().unwrap()
                );
                let new_h = self._update_step_size(factor)?;
                self._jacobian_updates(new_h * self.alpha[order], SolverState::ErrorTestFail);

                // new prediction
                self._predict_forward();

                // update statistics
                self.statistics.number_of_error_test_failures += 1;
                if self.statistics.number_of_error_test_failures - old_num_error_test_failures
                    >= self.config.maximum_error_test_failures
                {
                    return Err(DiffsolError::from(
                        OdeSolverError::TooManyErrorTestFailures {
                            time: self.state.t.to_f64().unwrap(),
                            num_failures: self.statistics.number_of_error_test_failures,
                        },
                    ));
                }
            }
        }

        // take the accepted step
        self.update_differences_and_integrate_out();

        {
            let state = &mut self.state;
            state.y.copy_from(&self.y_predict);
            state.t = self.t_predict;
            state.dy.copy_from_view(&state.diff.column(1));
            state.dy *= scale(Eqn::T::one() / state.h);
        }

        // update statistics
        if let Some(op) = self.op.as_ref() {
            self.statistics.number_of_linear_solver_setups = op.number_of_jac_evals();
        } else if let Some(s_op) = self.s_op.as_ref() {
            self.statistics.number_of_linear_solver_setups = s_op.number_of_jac_evals();
        }
        self.statistics.number_of_steps += 1;
        self.jacobian_update.step();

        // a change in order is only done after running at order k for k + 1 steps
        // (see page 83 of [2])
        self.n_equal_steps += 1;

        if self.n_equal_steps > self.state.order {
            let factors = {
                let order = self.state.order;
                // similar to the optimal step size factor we calculated above for the current
                // order k, we need to calculate the optimal step size factors for orders
                // k-1 and k+1. To do this, we note that the error = C_k * D^{k+1} y_n
                let error_m_norm = if order > 1 {
                    self.predict_error_control(order - 1)
                } else {
                    Eqn::T::INFINITY
                };
                let error_p_norm = if order < BdfState::<Eqn::V, M>::MAX_ORDER {
                    self.predict_error_control(order + 1)
                } else {
                    Eqn::T::INFINITY
                };

                let error_norms = [error_m_norm, error_norm, error_p_norm];
                error_norms
                    .into_iter()
                    .enumerate()
                    .map(|(i, error_norm)| {
                        error_norm.pow(
                            <Eqn::T as FromPrimitive>::from_f64(-0.5 / (i as f64 + order as f64))
                                .unwrap(),
                        )
                    })
                    .collect::<Vec<_>>()
            };

            // now we have the three factors for orders k-1, k and k+1, pick the maximum in
            // order to maximise the resultant step size
            let max_index = factors
                .iter()
                .enumerate()
                .max_by(|(_, a), (_, b)| a.partial_cmp(b).unwrap())
                .unwrap()
                .0;

            // update order and update the U matrix
            let order = {
                let old_order = self.state.order;
                let new_order = match max_index {
                    0 => old_order - 1,
                    1 => old_order,
                    2 => old_order + 1,
                    _ => unreachable!(),
                };
                self.state.order = new_order;
                if max_index != 1 {
                    self.u = Self::_compute_r(
                        new_order,
                        Eqn::T::one(),
                        self.problem().eqn.context().clone(),
                    );
                }
                new_order
            };

            let mut factor = safety * factors[max_index];
            if factor > self.config.maximum_timestep_growth {
                factor = self.config.maximum_timestep_growth;
            }
            if factor < self.config.minimum_timestep_shrink {
                factor = self.config.minimum_timestep_shrink;
            }
            if factor >= self.config.minimum_timestep_growth
                || factor <= self.config.maximum_timestep_shrink
                || max_index == 0
                || max_index == 2
            {
                let new_h = self._update_step_size(factor)?;
                debug!(
                    "Changing step size to {:.6} and order to {}",
                    new_h.to_f64().unwrap(),
                    order
                );
                self._jacobian_updates(new_h * self.alpha[order], SolverState::StepSuccess);
            }
        }

        // check for root within accepted step
        if let Some(root_fn) = self.ode_problem.eqn.root() {
            let ret = self.root_finder.as_ref().unwrap().check_root(
                &|t: <Eqn as Op>::T, y: &mut <Eqn as Op>::V| self.interpolate_inplace(t, y),
                &root_fn,
                self.state.as_ref().y,
                self.state.as_ref().t,
            );
            if let Some((root, root_idx)) = ret {
                debug!("Root found at time {}", root);
                return Ok(OdeSolverStopReason::RootFound(root, root_idx));
            }
        }

        if let Some(tstop) = self.tstop {
            if let Some(reason) = self.handle_tstop(tstop).unwrap() {
                return Ok(reason);
            }
        }

        // just a normal step, no roots or tstop reached
        Ok(OdeSolverStopReason::InternalTimestep)
    }

    fn set_stop_time(&mut self, tstop: <Eqn as Op>::T) -> Result<(), DiffsolError> {
        self.tstop = Some(tstop);
        if let Some(OdeSolverStopReason::TstopReached) = self.handle_tstop(tstop)? {
            let error = OdeSolverError::StopTimeAtCurrentTime;
            self.tstop = None;
            return Err(DiffsolError::from(error));
        }
        Ok(())
    }
}

#[cfg(test)]
mod test {
    use crate::{
        matrix::dense_nalgebra_serial::NalgebraMat,
        ode_equations::test_models::{
            dydt_y2::dydt_y2_problem,
            exponential_decay::{
                exponential_decay_problem, exponential_decay_problem_adjoint,
                exponential_decay_problem_sens, exponential_decay_problem_with_root,
                negative_exponential_decay_problem,
            },
            exponential_decay_with_algebraic::{
                exponential_decay_with_algebraic_adjoint_problem,
                exponential_decay_with_algebraic_problem,
                exponential_decay_with_algebraic_problem_sens,
            },
            foodweb::foodweb_problem,
            gaussian_decay::gaussian_decay_problem,
            heat2d::head2d_problem,
            logistic::logistic_problem_adjoint_no_out,
            robertson::{robertson, robertson_sens},
            robertson_ode::robertson_ode,
            robertson_ode_with_sens::robertson_ode_with_sens,
        },
        ode_solver::tests::{
            setup_test_adjoint, setup_test_adjoint_sum_squares, test_adjoint,
            test_adjoint_sum_squares, test_checkpointing, test_config, test_interpolate,
            test_interpolate_dy, test_ode_solver, test_problem, test_state_mut,
            test_state_mut_on_problem,
        },
        scale, ConstantOp, Context, DenseMatrix, FaerLU, FaerMat, FaerSparseLU, FaerSparseMat,
        MatrixCommon, NalgebraLU, OdeEquations, OdeSolverMethod, Op, Vector, VectorView,
    };

    type M = NalgebraMat<f64>;
    type LS = NalgebraLU<f64>;
    #[test]
    fn bdf_state_mut() {
        test_state_mut(test_problem::<M>(false).bdf::<LS>().unwrap());
    }

    #[test]
    fn bdf_config() {
        test_config(robertson_ode::<M>(false, 1).0.bdf::<LS>().unwrap());
    }

    #[test]
    fn bdf_test_interpolate() {
        test_interpolate(test_problem::<M>(false).bdf::<LS>().unwrap());
    }

    #[test]
    fn bdf_test_interpolate_out() {
        test_interpolate(test_problem::<M>(true).bdf::<LS>().unwrap());
    }

    #[test]
    fn bdf_test_interpolate_sens() {
        test_interpolate(test_problem::<M>(false).bdf_sens::<LS>().unwrap());
    }

    #[test]
    fn bdf_test_interpolate_dy() {
        test_interpolate_dy(test_problem::<M>(false).bdf::<LS>().unwrap());
    }

    #[test]
    fn bdf_test_state_mut_exponential_decay() {
        let (p, soln) = exponential_decay_problem::<M>(false);
        let s = p.bdf_solver::<LS>(p.bdf_state::<LS>().unwrap()).unwrap();
        test_state_mut_on_problem(s, soln);
    }

    #[test]
    fn bdf_test_nalgebra_negative_exponential_decay() {
        let (problem, soln) = negative_exponential_decay_problem::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[test]
    fn bdf_test_nalgebra_exponential_decay() {
        let (problem, soln) = exponential_decay_problem::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 12
        number_of_steps: 49
        number_of_error_test_failures: 0
        number_of_nonlinear_solver_iterations: 50
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 52
        number_of_jac_muls: 2
        number_of_matrix_evals: 1
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn bdf_test_faer_sparse_exponential_decay() {
        let (problem, soln) = exponential_decay_problem::<FaerSparseMat<f64>>(false);
        let mut s = problem.bdf::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[cfg(feature = "cuda")]
    #[test]
    fn bdf_test_cuda_exponential_decay() {
        use crate::{CudaLU, CudaMat};
        let (problem, soln) = exponential_decay_problem::<CudaMat<f64>>(false);
        let mut s = problem.bdf::<CudaLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[test]
    fn bdf_test_checkpointing() {
        let (problem, soln) = exponential_decay_problem::<M>(false);
        let solver1 = problem.bdf::<LS>().unwrap();
        let solver2 = problem.bdf::<LS>().unwrap();
        test_checkpointing(soln, solver1, solver2);
    }

    #[test]
    fn bdf_test_faer_exponential_decay() {
        type M = FaerMat<f64>;
        type LS = FaerLU<f64>;
        let (problem, soln) = exponential_decay_problem::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 12
        number_of_steps: 49
        number_of_error_test_failures: 0
        number_of_nonlinear_solver_iterations: 50
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 52
        number_of_jac_muls: 2
        number_of_matrix_evals: 1
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn bdf_test_nalgebra_exponential_decay_sens() {
        let (problem, soln) = exponential_decay_problem_sens::<M>(false);
        let mut s = problem.bdf_sens::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 14
        number_of_steps: 52
        number_of_error_test_failures: 1
        number_of_nonlinear_solver_iterations: 164
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.statistics(), @r###"
        number_of_calls: 56
        number_of_jac_muls: 114
        number_of_matrix_evals: 1
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn bdf_test_faer_sparse_exponential_decay_sens() {
        let (problem, soln) = exponential_decay_problem_sens::<FaerSparseMat<f64>>(false);
        let mut s = problem.bdf_sens::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_nalgebra_exponential_decay_diffsl_sens() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_problem_diffsl;
        let (problem, soln) = exponential_decay_problem_diffsl::<M, diffsl::LlvmModule>(false);
        let mut s = problem.bdf_sens::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 14
        number_of_steps: 52
        number_of_error_test_failures: 1
        number_of_nonlinear_solver_iterations: 164
        number_of_nonlinear_solver_fails: 0
        "###);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_faer_sparse_exponential_decay_diffsl_sens() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_problem_diffsl;
        type M = FaerSparseMat<f64>;
        type LS = FaerSparseLU<f64>;
        let (problem, soln) = exponential_decay_problem_diffsl::<M, diffsl::LlvmModule>(false);
        let mut s = problem.bdf_sens::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
    }

    #[test]
    fn bdf_test_nalgebra_exponential_decay_adjoint() {
        let (mut problem, soln) = exponential_decay_problem_adjoint::<M>(true);
        let final_time = soln.solution_points.last().unwrap().t;
        let dgdu = setup_test_adjoint::<LS, _>(&mut problem, soln);
        let (problem, _soln) = exponential_decay_problem_adjoint::<M>(true);
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, _y, _t, _stop_reason) =
            s.solve_with_checkpointing(final_time, None).unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdu.ncols()))
            .unwrap();
        test_adjoint(adjoint_solver, dgdu);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 159
        number_of_jac_muls: 2
        number_of_matrix_evals: 1
        number_of_jac_adj_muls: 222
        "###);
    }

    #[test]
    fn bdf_test_nalgebra_exponential_decay_adjoint_sum_squares() {
        let (mut problem, soln) = exponential_decay_problem_adjoint::<M>(false);
        let times = soln.solution_points.iter().map(|p| p.t).collect::<Vec<_>>();
        let (dgdp, data) = setup_test_adjoint_sum_squares::<LS, _>(&mut problem, times.as_slice());
        let (problem, _soln) = exponential_decay_problem_adjoint::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, soln, _stop_reason) = s
            .solve_dense_with_checkpointing(times.as_slice(), None)
            .unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdp.ncols()))
            .unwrap();
        test_adjoint_sum_squares(adjoint_solver, dgdp, soln, data, times.as_slice());
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 546
        number_of_jac_muls: 4
        number_of_matrix_evals: 2
        number_of_jac_adj_muls: 1056
        "###);
    }

    #[test]
    fn bdf_test_nalgebra_logistic_without_out() {
        let (problem, soln) = logistic_problem_adjoint_no_out::<M>();
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[test]
    fn bdf_test_nalgebra_logistic_without_out_adjoint_sum_squares() {
        let (mut problem, soln) = logistic_problem_adjoint_no_out::<M>();
        let times = soln.solution_points.iter().map(|p| p.t).collect::<Vec<_>>();
        let (dgdp, data) = setup_test_adjoint_sum_squares::<LS, _>(&mut problem, times.as_slice());
        let (problem, _soln) = logistic_problem_adjoint_no_out::<M>();
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, soln, _stop_reason) = s
            .solve_dense_with_checkpointing(times.as_slice(), None)
            .unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdp.ncols()))
            .unwrap();
        test_adjoint_sum_squares(adjoint_solver, dgdp, soln, data, times.as_slice());
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_nalgebra_exponential_decay_adjoint_diffsl() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_problem_diffsl;
        let (mut problem, soln) = exponential_decay_problem_diffsl::<M, diffsl::LlvmModule>(true);
        let final_time = soln.solution_points.last().unwrap().t;
        let dgdu = setup_test_adjoint::<LS, _>(&mut problem, soln);
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, _y, _t, _stop_reason) =
            s.solve_with_checkpointing(final_time, None).unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdu.ncols()))
            .unwrap();
        test_adjoint(adjoint_solver, dgdu);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_faer_sparse_exponential_decay_adjoint_diffsl() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_problem_diffsl;
        type M = FaerSparseMat<f64>;
        type LS = FaerSparseLU<f64>;
        let (mut problem, soln) = exponential_decay_problem_diffsl::<M, diffsl::LlvmModule>(true);
        let final_time = soln.solution_points.last().unwrap().t;
        let dgdu = setup_test_adjoint::<LS, _>(&mut problem, soln);
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, _y, _t, _stop_reason) =
            s.solve_with_checkpointing(final_time, None).unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdu.ncols()))
            .unwrap();
        test_adjoint(adjoint_solver, dgdu);
    }

    #[test]
    fn bdf_test_nalgebra_exponential_decay_algebraic_adjoint() {
        let (mut problem, soln) = exponential_decay_with_algebraic_adjoint_problem::<M>(true);
        let final_time = soln.solution_points.last().unwrap().t;
        let dgdu = setup_test_adjoint::<LS, _>(&mut problem, soln);
        let (problem, _soln) = exponential_decay_with_algebraic_adjoint_problem::<M>(true);
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, _y, _t, _stop_reason) =
            s.solve_with_checkpointing(final_time, None).unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdu.ncols()))
            .unwrap();
        test_adjoint(adjoint_solver, dgdu);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 151
        number_of_jac_muls: 15
        number_of_matrix_evals: 5
        number_of_jac_adj_muls: 96
        "###);
    }

    #[test]
    fn bdf_test_nalgebra_exponential_decay_algebraic_adjoint_sum_squares() {
        let (mut problem, soln) = exponential_decay_with_algebraic_adjoint_problem::<M>(false);
        let times = soln.solution_points.iter().map(|p| p.t).collect::<Vec<_>>();
        let (dgdp, data) = setup_test_adjoint_sum_squares::<LS, _>(&mut problem, times.as_slice());
        let (problem, _soln) = exponential_decay_with_algebraic_adjoint_problem::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, soln, _stop_reason) = s
            .solve_dense_with_checkpointing(times.as_slice(), None)
            .unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdp.ncols()))
            .unwrap();
        test_adjoint_sum_squares(adjoint_solver, dgdp, soln, data, times.as_slice());
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 220
        number_of_jac_muls: 15
        number_of_matrix_evals: 5
        number_of_jac_adj_muls: 414
        "###);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_nalgebra_exponential_decay_with_algebraic_adjoint_diffsl() {
        use crate::ode_equations::test_models::exponential_decay_with_algebraic::exponential_decay_with_algebraic_problem_diffsl;
        let (mut problem, soln) =
            exponential_decay_with_algebraic_problem_diffsl::<M, diffsl::LlvmModule>(true);
        let final_time = soln.solution_points.last().unwrap().t;
        let dgdu = setup_test_adjoint::<LS, _>(&mut problem, soln);
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, _y, _t, _stop_reason) =
            s.solve_with_checkpointing(final_time, None).unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, None)
            .unwrap();
        test_adjoint(adjoint_solver, dgdu);
    }

    #[test]
    fn test_bdf_nalgebra_exponential_decay_algebraic() {
        let (problem, soln) = exponential_decay_with_algebraic_problem::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 18
        number_of_steps: 38
        number_of_error_test_failures: 5
        number_of_nonlinear_solver_iterations: 49
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 53
        number_of_jac_muls: 6
        number_of_matrix_evals: 2
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn bdf_test_faer_sparse_exponential_decay_algebraic() {
        let (problem, soln) = exponential_decay_with_algebraic_problem::<FaerSparseMat<f64>>(false);
        let mut s = problem.bdf::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[test]
    fn test_bdf_nalgebra_exponential_decay_algebraic_sens() {
        let (problem, soln) = exponential_decay_with_algebraic_problem_sens::<M>();
        let mut s = problem.bdf_sens::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 23
        number_of_steps: 47
        number_of_error_test_failures: 8
        number_of_nonlinear_solver_iterations: 119
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 68
        number_of_jac_muls: 66
        number_of_matrix_evals: 3
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_faer_sparse_exponential_decay_algebraic_sens() {
        let (problem, soln) = exponential_decay_with_algebraic_problem_sens::<FaerSparseMat<f64>>();
        let mut s = problem.bdf_sens::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_nalgebra_exponential_decay_algebraic_diffsl_sens() {
        use crate::ode_equations::test_models::exponential_decay_with_algebraic::exponential_decay_with_algebraic_problem_diffsl;
        let (_problem, mut soln) = exponential_decay_with_algebraic_problem_sens::<M>();
        let (problem, _soln) =
            exponential_decay_with_algebraic_problem_diffsl::<M, diffsl::LlvmModule>(false);
        soln.atol = problem.atol.clone();
        soln.rtol = problem.rtol;
        let mut s = problem.bdf_sens::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 23
        number_of_steps: 47
        number_of_error_test_failures: 8
        number_of_nonlinear_solver_iterations: 119
        number_of_nonlinear_solver_fails: 0
        "###);
    }

    #[test]
    fn test_bdf_nalgebra_robertson() {
        let (problem, soln) = robertson::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 79
        number_of_steps: 328
        number_of_error_test_failures: 7
        number_of_nonlinear_solver_iterations: 648
        number_of_nonlinear_solver_fails: 13
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 651
        number_of_jac_muls: 45
        number_of_matrix_evals: 15
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn bdf_test_faer_sparse_robertson() {
        let (problem, soln) = robertson::<FaerSparseMat<f64>>(false);
        let mut s = problem.bdf::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[cfg(feature = "suitesparse")]
    #[test]
    fn bdf_test_faer_sparse_ku_robertson() {
        let (problem, soln) = robertson::<FaerSparseMat<f64>>(false);
        let mut s = problem.bdf::<crate::KLU<_>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_nalgebra_diffsl_robertson() {
        use diffsl::LlvmModule;

        use crate::ode_equations::test_models::robertson;
        let (problem, soln) = robertson::robertson_diffsl_problem::<M, LlvmModule>();
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn bdf_test_nalgebra_diffsl_robertson_ode_adjoint() {
        use crate::ode_equations::test_models::robertson_ode;
        use diffsl::LlvmModule;
        let (mut problem, soln) = robertson_ode::robertson_ode_diffsl_problem::<M, LlvmModule>();
        let times = soln.solution_points.iter().map(|p| p.t).collect::<Vec<_>>();
        let (dgdp, data) = setup_test_adjoint_sum_squares::<LS, _>(&mut problem, times.as_slice());
        let (mut problem, _soln) = robertson_ode::robertson_ode_diffsl_problem::<M, LlvmModule>();
        problem.ode_options.max_nonlinear_solver_failures = 1000;
        let mut s = problem.bdf::<LS>().unwrap();
        let (checkpointer, soln, _stop_reason) = s
            .solve_dense_with_checkpointing(times.as_slice(), None)
            .unwrap();
        let adjoint_solver = problem
            .bdf_solver_adjoint::<LS, _>(checkpointer, Some(dgdp.ncols()))
            .unwrap();
        test_adjoint_sum_squares(adjoint_solver, dgdp, soln, data, times.as_slice());
    }

    #[test]
    fn test_bdf_nalgebra_robertson_sens() {
        let (mut problem, soln) = robertson_sens::<M>();
        problem.ode_options.max_nonlinear_solver_failures = 70;
        let mut s = problem.bdf_sens::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 92
        number_of_steps: 319
        number_of_error_test_failures: 4
        number_of_nonlinear_solver_iterations: 1941
        number_of_nonlinear_solver_fails: 28
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 575
        number_of_jac_muls: 1522
        number_of_matrix_evals: 31
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_nalgebra_robertson_colored() {
        let (problem, soln) = robertson::<M>(true);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 79
        number_of_steps: 328
        number_of_error_test_failures: 7
        number_of_nonlinear_solver_iterations: 648
        number_of_nonlinear_solver_fails: 13
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 651
        number_of_jac_muls: 48
        number_of_matrix_evals: 15
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_nalgebra_robertson_ode() {
        let (problem, soln) = robertson_ode::<M>(false, 3);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 81
        number_of_steps: 400
        number_of_error_test_failures: 4
        number_of_nonlinear_solver_iterations: 828
        number_of_nonlinear_solver_fails: 4
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 830
        number_of_jac_muls: 81
        number_of_matrix_evals: 9
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_nalgebra_robertson_ode_sens() {
        let (problem, soln) = robertson_ode_with_sens::<M>(false);
        let mut s = problem.bdf_sens::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, true);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 218
        number_of_steps: 669
        number_of_error_test_failures: 110
        number_of_nonlinear_solver_iterations: 3785
        number_of_nonlinear_solver_fails: 15
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 1035
        number_of_jac_muls: 2845
        number_of_matrix_evals: 22
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_nalgebra_dydt_y2() {
        let (problem, soln) = dydt_y2_problem::<M>(false, 10);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 28
        number_of_steps: 156
        number_of_error_test_failures: 3
        number_of_nonlinear_solver_iterations: 283
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 285
        number_of_jac_muls: 30
        number_of_matrix_evals: 3
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_nalgebra_dydt_y2_colored() {
        let (problem, soln) = dydt_y2_problem::<M>(true, 10);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 28
        number_of_steps: 156
        number_of_error_test_failures: 3
        number_of_nonlinear_solver_iterations: 283
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 285
        number_of_jac_muls: 13
        number_of_matrix_evals: 3
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_nalgebra_gaussian_decay() {
        let (problem, soln) = gaussian_decay_problem::<M>(false, 10);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 17
        number_of_steps: 64
        number_of_error_test_failures: 3
        number_of_nonlinear_solver_iterations: 92
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 94
        number_of_jac_muls: 20
        number_of_matrix_evals: 2
        number_of_jac_adj_muls: 0
        "###);
    }

    #[test]
    fn test_bdf_faer_sparse_heat2d() {
        let (problem, soln) = head2d_problem::<FaerSparseMat<f64>, 10>();
        let mut s = problem.bdf::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 21
        number_of_steps: 168
        number_of_error_test_failures: 0
        number_of_nonlinear_solver_iterations: 180
        number_of_nonlinear_solver_fails: 0
        "###);
        insta::assert_yaml_snapshot!(problem.eqn.rhs().statistics(), @r###"
        number_of_calls: 183
        number_of_jac_muls: 128
        number_of_matrix_evals: 4
        number_of_jac_adj_muls: 0
        "###);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn test_bdf_faer_sparse_heat2d_diffsl() {
        use diffsl::LlvmModule;

        use crate::ode_equations::test_models::heat2d;
        let (problem, soln) = heat2d::heat2d_diffsl_problem::<FaerSparseMat<f64>, LlvmModule, 10>();
        let mut s = problem.bdf::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[test]
    fn test_bdf_faer_sparse_foodweb() {
        let (problem, soln) = foodweb_problem::<FaerSparseMat<f64>, 10>();
        let mut s = problem.bdf::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
        insta::assert_yaml_snapshot!(s.get_statistics(), @r###"
        number_of_linear_solver_setups: 41
        number_of_steps: 167
        number_of_error_test_failures: 2
        number_of_nonlinear_solver_iterations: 451
        number_of_nonlinear_solver_fails: 13
        "###);
    }

    #[cfg(feature = "diffsl-llvm")]
    #[test]
    fn test_bdf_faer_sparse_foodweb_diffsl() {
        use crate::ode_equations::test_models::foodweb;
        use diffsl::LlvmModule;
        let (problem, soln) =
            foodweb::foodweb_diffsl_problem::<FaerSparseMat<f64>, LlvmModule, 10>();
        let mut s = problem.bdf::<FaerSparseLU<f64>>().unwrap();
        test_ode_solver(&mut s, soln, None, false, false);
    }

    #[test]
    fn test_tstop_bdf() {
        let (problem, soln) = exponential_decay_problem::<M>(false);
        let mut s = problem.bdf::<LS>().unwrap();
        test_ode_solver(&mut s, soln, None, true, false);
    }

    #[test]
    fn test_root_finder_bdf() {
        let (problem, soln) = exponential_decay_problem_with_root::<M>(false, true);
        let mut s = problem.bdf::<LS>().unwrap();
        let y = test_ode_solver(&mut s, soln, None, false, false);

        let y0 = problem.eqn.init().call(0.0);
        let mut p = problem.context().vector_zeros(2);
        problem.eqn.get_params(&mut p);
        let k = p.get_index(0);
        let target = 0.6_f64;
        let t_root = -((target / y0.get_index(0)).ln()) / k;
        let expected = y0.clone() * scale(f64::exp(-k * t_root));
        y.assert_eq_norm(&expected, &problem.atol, problem.rtol, 15.0);

        let g = s.interpolate_out(t_root).unwrap();
        let integral = (1.0 - f64::exp(-k * t_root)) / k;
        let expected_g = y0 * scale(integral);
        g.assert_eq_norm(&expected_g, &problem.atol, problem.rtol, 15.0);
    }

    #[test]
    fn test_param_sweep_bdf() {
        let (mut problem, _soln) = exponential_decay_problem::<M>(false);
        let ctx = problem.eqn.context();
        let mut ps = Vec::new();
        for y0 in (1..10).map(f64::from) {
            ps.push(ctx.vector_from_vec(vec![0.1, y0]));
        }

        let mut old_soln: Option<<M as MatrixCommon>::V> = None;
        for p in ps {
            problem.eqn_mut().set_params(&p);
            let mut s = problem.bdf::<LS>().unwrap();
            let (ys, _ts, _stop_reason) = s.solve(10.0).unwrap();
            // check that the new solution is different from the old one
            if let Some(old_soln) = &mut old_soln {
                let new_soln = ys.column(ys.ncols() - 1).into_owned();
                let error = new_soln - &*old_soln;
                let diff = error
                    .squared_norm(old_soln, &problem.atol, problem.rtol)
                    .sqrt();
                assert!(diff > 1.0e-6, "diff: {diff}");
            }
            old_soln = Some(ys.column(ys.ncols() - 1).into_owned());
        }
    }

    #[cfg(feature = "diffsl-cranelift")]
    #[test]
    fn test_ball_bounce_bdf() {
        use crate::ode_solver::tests::test_ball_bounce_problem;
        type M = crate::NalgebraMat<f64>;
        type LS = crate::NalgebraLU<f64>;
        let (x, v, t) = crate::ode_solver::tests::test_ball_bounce(
            test_ball_bounce_problem::<M>().bdf::<LS>().unwrap(),
        );

        let expected_x = [
            0.003978879413779122,
            0.007955671343150521,
            0.015904102550507716,
        ];
        let expected_v = [11.202229406994425, 11.198746111635534, 11.191779520917754];
        let expected_t = [1.4281779078441663, 1.4285126937676944, 1.4292157442071036];
        for (i, ((x, v), t)) in x.iter().zip(v.iter()).zip(t.iter()).enumerate() {
            assert!(
                (x - expected_x[i]).abs() < 1e-4,
                "x: {} expected: {}",
                x,
                expected_x[i]
            );
            assert!(
                (v - expected_v[i]).abs() < 1e-4,
                "v: {} expected: {}",
                v,
                expected_v[i]
            );
            assert!(
                (t - expected_t[i]).abs() < 1e-4,
                "t: {} expected: {}",
                t,
                expected_t[i]
            );
        }
    }

    /// Test that `step()` includes the root index in `RootFound(t, index)`.
    ///
    /// Uses a two-output root function (no Reset); root 0 fires at t ≈ 5.108
    /// (exponential decay y[0] = 0.6, k=0.1) and the test verifies the returned index is 0.
    #[test]
    fn test_root_found_index_bdf() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_with_two_roots_problem;
        use crate::ode_solver::tests::test_root_found_index;
        let (problem, soln) = exponential_decay_with_two_roots_problem::<M>();
        let solver = problem.bdf::<LS>().unwrap();
        test_root_found_index(solver, &soln, 0, 1e-4);
    }

    /// Test that `solve()` halts on the first root, even when a reset function is configured.
    #[test]
    fn test_solve_with_reset_bdf() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_with_reset_problem;
        use crate::ode_solver::tests::test_solve_with_reset;
        let (problem, soln) = exponential_decay_with_reset_problem::<M>();
        let solver = problem.bdf::<LS>().unwrap();
        test_solve_with_reset(solver, &soln);
    }

    /// Test that `solve_dense()` halts on the first root, even when a reset function is configured.
    #[test]
    fn test_solve_dense_with_reset_bdf() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_with_reset_problem;
        use crate::ode_solver::tests::test_solve_dense_with_reset;
        let (problem, soln) = exponential_decay_with_reset_problem::<M>();
        let solver = problem.bdf::<LS>().unwrap();
        test_solve_dense_with_reset(solver, &soln);
    }

    /// Test that `solve_dense_sensitivities()` halts on the first root for BDF.
    #[test]
    fn test_solve_dense_sensitivities_with_reset_bdf() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_with_reset_problem_sens;
        use crate::ode_solver::tests::test_solve_dense_sensitivities_with_reset;
        let (problem, soln) = exponential_decay_with_reset_problem_sens::<M>();
        let solver = problem.bdf_sens::<LS>().unwrap();
        test_solve_dense_sensitivities_with_reset(solver, &soln);
    }

    #[test]
    fn test_solve_adjoint_with_single_reset_root_bdf() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_with_single_reset_root_problem_adjoint;
        use crate::ode_solver::tests::test_solve_adjoint_with_single_reset_root;
        let (problem, soln) = exponential_decay_with_single_reset_root_problem_adjoint::<M>(true);
        test_solve_adjoint_with_single_reset_root(
            |state| match state {
                Some(state) => problem.bdf_solver(state),
                None => problem.bdf::<LS>(),
            },
            &soln,
            |adjoint_eqn| problem.bdf_state_adjoint::<LS, _>(adjoint_eqn),
            |state, adjoint_eqn| problem.bdf_solver_adjoint_from_state::<LS, _>(state, adjoint_eqn),
        );
    }

    #[test]
    fn test_solve_adjoint_sum_squares_with_single_reset_root_bdf() {
        use crate::ode_equations::test_models::exponential_decay::exponential_decay_with_single_reset_root_problem_adjoint;
        use crate::ode_solver::tests::{
            setup_test_adjoint_sum_squares_with_single_reset_root,
            single_reset_root_discrete_times,
            test_solve_adjoint_sum_squares_with_single_reset_root,
        };
        let (mut problem, soln) =
            exponential_decay_with_single_reset_root_problem_adjoint::<M>(false);
        let times = single_reset_root_discrete_times(soln.solution_points[0].t);
        let (dgdp, data) = setup_test_adjoint_sum_squares_with_single_reset_root::<LS, _>(
            &mut problem,
            times.as_slice(),
        );
        let (problem, soln) = exponential_decay_with_single_reset_root_problem_adjoint::<M>(false);
        test_solve_adjoint_sum_squares_with_single_reset_root(
            |state| match state {
                Some(state) => problem.bdf_solver(state),
                None => problem.bdf::<LS>(),
            },
            &soln,
            |adjoint_eqn| problem.bdf_state_adjoint::<LS, _>(adjoint_eqn),
            |state, adjoint_eqn| problem.bdf_solver_adjoint_from_state::<LS, _>(state, adjoint_eqn),
            dgdp,
            data,
            times.as_slice(),
        );
    }

    #[test]
    fn bdf_clone_resets_statistics_and_preserves_operator_presence() {
        let (problem, _soln) = exponential_decay_problem::<M>(false);
        let mut solver = problem.bdf::<LS>().unwrap();
        solver.step().unwrap();
        assert!(solver.get_statistics().number_of_steps > 0);
        assert!(solver.op.is_some());
        assert!(solver.s_op.is_none());

        let cloned = solver.clone();
        assert!(cloned.op.is_some());
        assert!(cloned.s_op.is_none());
        assert_eq!(cloned.get_statistics().number_of_steps, 0);
        assert_eq!(cloned.state().t, solver.state().t);
    }

    #[test]
    fn bdf_clone_preserves_sensitivity_operator_and_resets_statistics() {
        let (problem, _soln) = exponential_decay_problem_sens::<M>(false);
        let mut solver = problem.bdf_sens::<LS>().unwrap();
        solver.step().unwrap();
        assert!(solver.get_statistics().number_of_steps > 0);
        assert!(solver.op.is_some());
        assert!(solver.s_op.is_some());

        let cloned = solver.clone();
        assert!(cloned.op.is_some());
        assert!(cloned.s_op.is_some());
        assert_eq!(cloned.get_statistics().number_of_steps, 0);
        assert_eq!(cloned.state().s.len(), solver.state().s.len());
    }
}