We study the quasi-ergodicity of compact strong Feller semigroups $U_t$, $t> 0$, on $L^2(M,\mu )$; we assume that M is a locally compact Polish space equipped with a locally finite Borel measue $\mu $. The operators $U_t$ are ultracontractive and positivity preserving, but not necessarily self-adjoint or normal. We are mainly interested in those cases where the measure $\mu $ is infinite and the semigroup is not intrinsically ultracontractive. We relate quasi-ergodicity on $L^p(M,\mu )$ and uniqueness of the quasi-stationary measure with the finiteness of the heat content of the semigroup (for large values of t) and with the progressive uniform ground state domination property. The latter property is equivalent to a variant of quasi-ergodicity which progressively propagates in space as $t \uparrow \infty $; the propagation rate is determined by the decay of . We discuss several applications and illustrate our results with examples. This includes a complete description of quasi-ergodicity for a large class of semigroups corresponding to non-local Schrödinger operators with confining potentials.

The aim of this paper is to prove a qualitative property, namely the preservation of positivity, for Schrödinger-type operators acting on $L^p$ functions defined on (possibly incomplete) Riemannian manifolds. A key assumption is a control of the behaviour of the potential of the operator near the Cauchy boundary of the manifolds. As a by-product, we establish the essential self-adjointness of such operators, as well as its generalization to the case $p\neq 2$, i.e. the fact that smooth compactly supported functions are an operator core for the Schrödinger operator in $L^p$.

We give a sharp estimate for the first eigenvalue of the Schrödinger operator $L:=-\Delta -\sigma $ which is defined on the closed minimal submanifold $M^{n}$ in the unit sphere $\mathbb {S}^{n+m}$, where $\sigma $ is the square norm of the second fundamental form.

In this paper we analyze the convergence of the following type of series

$$\begin{eqnarray}T_{N}^{{\mathcal{L}}}f(x)=\mathop{\sum }_{j=N_{1}}^{N_{2}}v_{j}\big(e^{-a_{j+1}{\mathcal{L}}}f(x)-e^{-a_{j}{\mathcal{L}}}f(x)\big),\quad x\in \mathbb{R}^{n},\end{eqnarray}$$

${\{e^{-t{\mathcal{L}}}\}}_{t>0}$

${\mathcal{L}}=-\unicode[STIX]{x1D6E5}+V$

$\unicode[STIX]{x1D6E5}$

$V$

$RH_{q}$

$q>n/2$

$n\geqslant 3$

$N=(N_{1},N_{2})\in \mathbb{Z}^{2}$

$N_{1}<N_{2}$

${\{v_{j}\}}_{j\in \mathbb{Z}}$

${\{a_{j}\}}_{j\in \mathbb{Z}}$

Our analysis will consist in the boundedness, in $L^{p}(\mathbb{R}^{n})$ and in $BMO(\mathbb{R}^{n})$, of the operators $T_{N}^{{\mathcal{L}}}$ and its maximal operator $T^{\ast }f(x)=\sup _{N}T_{N}^{{\mathcal{L}}}f(x)$.

It is also shown that the local size of the maximal differential transform operators (with $V=0$) is the same with the order of a singular integral for functions $f$ having local support. Moreover, if ${\{v_{j}\}}_{j\in \mathbb{Z}}\in \ell ^{p}(\mathbb{Z})$, we get an intermediate size between the local size of singular integrals and Hardy–Littlewood maximal operator.

We consider the Laplace operator in a tubular neighbourhood of a conical surface of revolution, subject to an Aharonov-Bohm magnetic field supported on the axis of symmetry and Dirichlet boundary conditions on the boundary of the domain. We show that there exists a critical total magnetic flux depending on the aperture of the conical surface for which the system undergoes an abrupt spectral transition from infinitely many eigenvalues below the essential spectrum to an empty discrete spectrum. For the critical flux, we establish a Hardy-type inequality. In the regime with an infinite discrete spectrum, we obtain sharp spectral asymptotics with a refined estimate of the remainder and investigate the dependence of the eigenvalues on the aperture of the surface and the flux of the magnetic field.

Let $(M^{n},g)$ be a Riemannian manifold without boundary. We study the amount of initial regularity required so that the solution to a free Schrödinger equation converges pointwise to its initial data. Assume the initial data is in $H^{\unicode[STIX]{x1D6FC}}(M)$. For hyperbolic space, the standard sphere, and the two-dimensional torus, we prove that $\unicode[STIX]{x1D6FC}>\frac{1}{2}$ is enough. For general compact manifolds, due to the lack of a local smoothing effect, it is hard to improve on the bound $\unicode[STIX]{x1D6FC}>1$ from interpolation. We managed to go below 1 for dimension ${\leqslant}$ 3. The more interesting thing is that, for a one-dimensional compact manifold, $\unicode[STIX]{x1D6FC}>\frac{1}{3}$ is sufficient.

In this paper we establish the endpoint estimates and Hardy type estimates for the Riesz transform associated with the generalized Schrödinger operator.

Let ${\mathcal{L}}=-\unicode[STIX]{x1D6E5}+{\mathcal{V}}$ be a Schrödinger operator on $\mathbb{R}^{n},n\geq 3$, where ${\mathcal{V}}$ is a potential satisfying an appropriate reverse Hölder inequality. In this paper, we prove the boundedness of the Riesz transforms and the Littlewood–Paley square function associated with Schrödinger operators ${\mathcal{L}}$ in some new function spaces, such as new weighted Bounded Mean Oscillation (BMO) and weighted Lipschitz spaces, associated with ${\mathcal{L}}$. Our results extend certain well-known results.

This paper deals with the spectral properties of self-adjoint Schrödinger operators with δʹ-type conditions on infinite regular trees. Firstly, we discuss the semi-boundedness and self-adjointness of this kind of Schrödinger operator. Secondly, by using the form approach, we give the necessary and sufficient condition that ensures that the spectra of the self-adjoint Schrödinger operators with δʹ-type conditions are discrete.

Let $H=-\unicode[STIX]{x1D6E5}+V$ be a Schrödinger operator with some general signed potential $V$. This paper is mainly devoted to establishing the $L^{q}$-boundedness of the Riesz transform $\unicode[STIX]{x1D6FB}H^{-1/2}$ for $q>2$. We mainly prove that under certain conditions on $V$, the Riesz transform $\unicode[STIX]{x1D6FB}H^{-1/2}$ is bounded on $L^{q}$ for all $q\in [2,p_{0})$ with a given $2<p_{0}<n$. As an application, the main result can be applied to the operator $H=-\unicode[STIX]{x1D6E5}+V_{+}-V_{-}$, where $V_{+}$ belongs to the reverse Hölder class $B_{\unicode[STIX]{x1D703}}$ and $V_{-}\in L^{n/2,\infty }$ with a small norm. In particular, if $V_{-}=-\unicode[STIX]{x1D6FE}|x|^{-2}$ for some positive number $\unicode[STIX]{x1D6FE}$, $\unicode[STIX]{x1D6FB}H^{-1/2}$ is bounded on $L^{q}$ for all $q\in [2,n/2)$ and $n>4$.

In this paper we perform a numerical study of the spectra, eigenstates, and Lyapunov exponents of the skew-shift counterpart to Harper’s equation. This study is motivated by various conjectures on the spectral theory of these ‘pseudo-random’ models, which are reviewed in detail in the initial sections of the paper. The numerics carried out at different scales are within agreement with the conjectures and show a striking difference compared with the spectral features of the Almost Mathieu model. In particular our numerics establish a small upper bound on the gaps in the spectrum (conjectured to be absent).

Let L=−Δ+V be a Schrödinger operator on ℝn where V is a nonnegative function in the space L1loc(ℝn) of locally integrable functions on ℝn. In this paper we provide an atomic decomposition for the Hardy space H1L(ℝn) associated to L in terms of the maximal function characterization. We then adapt our argument to give an atomic decomposition for the Hardy space H1L(ℝn×ℝn) on product domains.

This paper considers Schrödinger operators, and presents a probabilistic interpretation of the variation (or shape derivative) of the Dirichlet groundstate energy when the associated domain is perturbed. This interpretation relies on the distribution on the boundary of a stopped random process with Feynman-Kac weights. Practical computations require in addition the explicit approximation of the normal derivative of the groundstate on the boundary. We then propose to use this formulation in the case of the so-called fixed node approximation of Fermion groundstates, defined by the bottom eigenelements of the Schrödinger operator of a Fermionic system with Dirichlet conditions on the nodes (the set of zeros) of an initially guessed skew-symmetric function. We show that shape derivatives of the fixed node energy vanishes if and only if either (i) the distribution on the nodes of the stopped random process is symmetric; or (ii) the nodes are exactly the zeros of a skew-symmetric eigenfunction of the operator. We propose an approximation of the shape derivative of the fixed node energy that can be computed with a Monte-Carlo algorithm, which can be referred to as Nodal Monte-Carlo (NMC). The latter approximation of the shape derivative also vanishes if and only if either (i) or (ii) holds.

In this paper, we discuss the H1L-boundedness of commutators of Riesz transforms associated with the Schrödinger operator L=−△+V, where H1L(Rn) is the Hardy space associated with L. We assume that V (x) is a nonzero, nonnegative potential which belongs to Bq for some q>n/2. Let T1=V (x)(−△+V )−1, T2=V1/2(−△+V )−1/2 and T3 =∇(−△+V )−1/2. We prove that, for b∈BMO (Rn) , the commutator [b,T3 ] is not bounded from H1L(Rn) to L1 (Rn) as T3 itself. As an alternative, we obtain that [b,Ti ] , ( i=1,2,3 ) are of (H1L,L1weak) -boundedness.

We classify the hulls of different limit-periodic potentials and show that the hull of alimit-periodic potential is a procyclic group. We describe how limit-periodic potentialscan be generated from a procyclic group and answer arising questions. As an expositorypaper, we discuss the connection between limit-periodic potentials and profinite groups ascompletely as possible and review some recent results on Schrödinger operators obtained inthis context.

We study the potential which minimizes the fundamental gap of theSchrödinger operator under the total mass constraint. We considerthe relaxed potential and prove a regularity result for the optimalone, we also give a description of it. A consequence of this resultis the existence of an optimal potential under L 1 constraints.


The Diffusion Monte Carlo method is devoted to the computation ofelectronic ground-state energies of molecules. In this paper, we focus onimplementations of this method which consist in exploring theconfiguration space with a fixed number of random walkers evolvingaccording to a stochastic differential equation discretized in time. Weallow stochastic reconfigurations of the walkers to reduce thediscrepancy between the weights that they carry. On a simpleone-dimensional example, we prove the convergence of the method for afixed number of reconfigurations when the number of walkers tends to+∞ while the timestep tends to 0. We confirm our theoreticalrates of convergence by numerical experiments. Various resamplingalgorithms are investigated, both theoretically and numerically.