FATODE: A Library for Forward, Adjoint, and Tangent Linear Integration of ODEs

FATODE is a FORTRAN library for the integration of ordinary differential equations with direct and adjoint sensitivity analysis capabilities. The paper describes the capabilities, implementation, code organization, and usage of this package. FATODE implements four families of methods -- explicit Runge-Kutta for nonstiff problems and fully implicit Runge-Kutta, singly diagonally implicit Runge-Kutta, and Rosenbrock for stiff problems. Each family contains several methods with different orders of accuracy; users can add new methods by simply providing their coefficients. For each family the forward, adjoint, and tangent linear models are implemented. General purpose solvers for dense and sparse linear algebra are used; users can easily incorporate problem-tailored linear algebra routines. The performance of the package is demonstrated on several test problems. To the best of our knowledge FATODE is the first publicly available general purpose package that offers forward and adjoint sensitivity analysis capabilities in the context of Runge Kutta methods. A wide range of applications are expected to benefit from its use; examples include parameter estimation, data assimilation, optimal control, and uncertainty quantification

Comparison of POD reduced order strategies for the nonlinear 2D Shallow Water Equations

This paper introduces tensorial calculus techniques in the framework of Proper Orthogonal Decomposition (POD) to reduce the computational complexity of the reduced nonlinear terms. The resulting method, named tensorial POD, can be applied to polynomial nonlinearities of any degree $p$. Such nonlinear terms have an on-line complexity of $\mathcal{O}(k^{p+1})$, where $k$ is the dimension of POD basis, and therefore is independent of full space dimension. However it is efficient only for quadratic nonlinear terms since for higher nonlinearities standard POD proves to be less time consuming once the POD basis dimension $k$ is increased. Numerical experiments are carried out with a two dimensional shallow water equation (SWE) test problem to compare the performance of tensorial POD, standard POD, and POD/Discrete Empirical Interpolation Method (DEIM). Numerical results show that tensorial POD decreases by $76\times$ times the computational cost of the on-line stage of standard POD for configurations using more than $300,000$ model variables. The tensorial POD SWE model was only $2-8\times$ slower than the POD/DEIM SWE model but the implementation effort is considerably increased. Tensorial calculus was again employed to construct a new algorithm allowing POD/DEIM shallow water equation model to compute its off-line stage faster than the standard and tensorial POD approaches.Comment: 23 pages, 8 figures, 5 table

Reverse Engineering of Initial & Boundary Conditions with TELEMAC and Algorithmic Differentiation

Numerical Aspect