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In this paper, we generalize the algorithm described by Rump and Graillat, as well as our previous work on certifying breadth-one singular solutions of polynomial systems, to compute verified and narrow error bounds such that a slightly perturbed system is guaranteed to possess an isolated singular solution within the computed bounds. Our new verification method is based on deflation techniques using smoothing parameters. We demonstrate the performance of the algorithm for systems with singular solutions of multiplicity up to hundreds.
This paper is concerned with certifying that a given point is near an exact root of an overdetermined or singular polynomial system with rational coefficients. The difficulty lies in the fact that consistency of overdetermined systems is not a continuous property. Our certification is based on hybrid symbolic-numeric methods to compute the exact rational univariate representation (RUR) of a component of the input system from approximate roots. For overdetermined polynomial systems with simple roots, we compute an initial RUR from approximate roots. The accuracy of the RUR is increased via Newton iterations until the exact RUR is found, which we certify using exact arithmetic. Since the RUR is well-constrained, we can use it to certify the given approximate roots using alpha-theory. To certify isolated singular roots, we use a determinantal form of the isosingular deflation, which adds new polynomials to the original system without introducing new variables. The resulting polynomial system is overdetermined, but the roots are now simple, thereby reducing the problem to the overdetermined case. We prove that our algorithms have complexity that are polynomial in the input plus the output size upon successful convergence, and we use worst case upper bounds for termination when our iteration does not converge to an exact RUR. Examples are included to demonstrate the approach.
Dynamical spectral estimation is a well-established numerical approach for estimating eigenvalues and eigenfunctions of the Markov transition operator from trajectory data. Although the approach has been widely applied in biomolecular simulations, its error properties remain poorly understood. Here we analyze the error of a dynamical spectral estimation method called the variational approach to conformational dynamics (VAC). We bound the approximation error and estimation error for VAC estimates. Our analysis establishes VACs convergence properties and suggests new strategies for tuning VAC to improve accuracy.
Convex hulls of monomials have been widely studied in the literature, and monomial convexifications are implemented in global optimization software for relaxing polynomials. However, there has been no study of the error in the global optimum from such approaches. We give bounds on the worst-case error for convexifying a monomial over subsets of $[0,1]^n$. This implies additive error bounds for relaxing a polynomial optimization problem by convexifying each monomial separately. Our main error bounds depend primarily on the degree of the monomial, making them easy to compute. Since monomial convexification studies depend on the bounds on the associated variables, in the second part, we conduct an error analysis for a multilinear monomial over two different types of box constraints. As part of this analysis, we also derive the convex hull of a multilinear monomial over $[-1,1]^n$.
We analyze the Lanczos method for matrix function approximation (Lanczos-FA), an iterative algorithm for computing $f(mathbf{A}) mathbf{b}$ when $mathbf{A}$ is a Hermitian matrix and $mathbf{b}$ is a given mathbftor. Assuming that $f : mathbb{C} rightarrow mathbb{C}$ is piecewise analytic, we give a framework, based on the Cauchy integral formula, which can be used to derive {em a priori} and emph{a posteriori} error bounds for Lanczos-FA in terms of the error of Lanczos used to solve linear systems. Unlike many error bounds for Lanczos-FA, these bounds account for fine-grained properties of the spectrum of $mathbf{A}$, such as clustered or isolated eigenvalues. Our results are derived assuming exact arithmetic, but we show that they are easily extended to finite precision computations using existing theory about the Lanczos algorithm in finite precision. We also provide generalized bounds for the Lanczos method used to approximate quadratic forms $mathbf{b}^textsf{H} f(mathbf{A}) mathbf{b}$, and demonstrate the effectiveness of our bounds with numerical experiments.
Due to their importance in both data analysis and numerical algorithms, low rank approximations have recently been widely studied. They enable the handling of very large matrices. Tight error bounds for the computationally efficient Gaussian elimination based methods (skeleton approximations) are available. In practice, these bounds are useful for matrices with singular values which decrease quickly. Using the Chebyshev norm, this paper provides improved bounds for the errors of the matrix elements. These bounds are substantially better in the practically relevant cases where the eigenvalues decrease polynomially. Results are proven for general real rectangular matrices. Even stronger bounds are obtained for symmetric positive definite matrices. A simple example is given, comparing these new bounds to earlier ones.