The mixed regularity of electronic wave functions in fractional order and weighted Sobolev spaces
(2012)
The paper continues the study of the regularity of electronic wave functions in Hilbert spaces of mixed derivatives. It is shown that the eigenfunctions of electronic Schr\"odinger operators and their
exponentially weighted counterparts possess, roughly speaking, square integrable mixed weak derivatives of fractional order $\vartheta$ for $\vartheta<3/4$. The bound $3/4$ is best possible and can neither be reached nor surpassed. Such results are important for the study
of sparse grid-like expansions of the wave functions and show that their asymptotic convergence rate measured in terms of the number of ansatz functions involved does not deteriorate with the number of electrons.
The chemical master equation is a fundamental equation in chemical kinetics. It is an adequate substitute for the classical reaction-rate equations whenever stochastic effects become relevant. In the present paper we give a simple argument showing that the solutions of a large class of chemical master equations, including all those in which elementary reactions between two and more molecules do not generate a larger number of molecules than existed before,
are bounded in weighted $\ell_1$-spaces. As an illustration for the implications of this kind of regularity we analyze the effect of truncating the state space. This leads to an error analysis of the finite state projection of the chemical master equation, an approximation that underlies many numerical methods.