Search results for " Convergence"
showing 10 items of 260 documents
Multiphoton-ionization transition amplitudes and the Keldysh approximation.
1989
The Keldysh approximation to treat the multiphoton ionization of atoms is reconsidered. It is shown that, if one consistently uses the hypothesis under which the approximation should be valid (essentially, that of a weak, short-range binding potential), a Keldysh-like term results as an approximation to the first term of a uniformly convergent series in powers of the binding potential. No cancellation occurs when higher-order terms are taken into account. This result allows one to consider the Keldysh approximation as a well-defined theoretical model, without implying, however, that it is adequate to describe multiphoton ionization of real atoms.
Assessment of the accuracy of coupled cluster perturbation theory for open-shell systems. I. Triples expansions
2016
The accuracy at which total energies of open-shell atoms and organic radicals may be calculated is assessed for selected coupled cluster perturbative triples expansions, all of which augment the coupled cluster singles and doubles (CCSD) energy by a non-iterative correction for the effect of triple excitations. Namely, the second- through sixth-order models of the recently proposed CCSD(T-n) triples series [J. Chem. Phys. 140, 064108 (2014)] are compared to the acclaimed CCSD(T) model for both unrestricted as well as restricted open-shell Hartree-Fock (UHF/ROHF) reference determinants. By comparing UHF- and ROHF-based statistical results for a test set of 18 modest-sized open-shell species …
Relaxation of periodic and nonstandard growth integrals by means of two-scale convergence
2019
An integral representation result is obtained for the variational limit of the family functionals $\int_{\Omega}f\left(\frac{x}{\varepsilon}, Du\right)dx$, as $\varepsilon \to 0$, when the integrand $f = f (x,v)$ is a Carath\'eodory function, periodic in $x$, convex in $v$ and with nonstandard growth.
Effective theory for low-energy nuclear energy density functionals
2012
We introduce a new class of effective interactions to be used within the energy-density-functional approaches. They are based on regularized zero-range interactions and constitute a consistent application of the effective-theory methodology to low-energy phenomena in nuclei. They allow for defining the order of expansion in terms of the order of derivatives acting on the finite-range potential. Numerical calculations show a rapid convergence of the expansion and independence of results of the regularization scale.
Comparison of two non-primitive methods for path integral simulations: Higher-order corrections vs. an effective propagator approach
2002
Two methods are compared that are used in path integral simulations. Both methods aim to achieve faster convergence to the quantum limit than the so-called primitive algorithm (PA). One method, originally proposed by Takahashi and Imada, is based on a higher-order approximation (HOA) of the quantum mechanical density operator. The other method is based upon an effective propagator (EPr). This propagator is constructed such that it produces correctly one and two-particle imaginary time correlation functions in the limit of small densities even for finite Trotter numbers P. We discuss the conceptual differences between both methods and compare the convergence rate of both approaches. While th…
Quantitative approximation of certain stochastic integrals
2002
We approximate certain stochastic integrals, typically appearing in Stochastic Finance, by stochastic integrals over integrands, which are path-wise constant within deterministic, but not necessarily equidistant, time intervals. We ask for rates of convergence if the approximation error is considered in L 2 . In particular, we show that by using non-equidistant time nets, in contrast to equidistant time nets, approximation rates can be improved considerably.
Superconvergence phenomenon in the finite element method arising from averaging gradients
1984
We study a superconvergence phenomenon which can be obtained when solving a 2nd order elliptic problem by the usual linear elements. The averaged gradient is a piecewise linear continuous vector field, the value of which at any nodal point is an average of gradients of linear elements on triangles incident with this nodal point. The convergence rate of the averaged gradient to an exact gradient in theL 2-norm can locally be higher even by one than that of the original piecewise constant discrete gradient.
VARIANTS OF A SELECTION PRINCIPLE FOR SEQUENCES OF REGULATED AND NON-REGULATED FUNCTIONS
2008
Let $T$ be a nonempty subset of $\RB$, $X$ a metric space with metric $d$ and $X^T$ the set of all functions mapping $T$ into $X$. Given $\vep>0$ and $f\in X^T$, we denote by $N(\vep,f,T)$ the least upper bound of those $n\in\NB$, for which there exist numbers $s_1,\dots,s_n,t_1,\dots,t_n$ from $T$ such that $s_1\vep$ for all $i=1,\dots,n$ ($N(\vep,f,T)=0$ if there are no such $n$'s). The following pointwise selection principle is proved: {\em If a sequence of functions\/ $\{f_j\}_{j=1}^\infty\subset X^T$ is such that the closure in $X$ of the sequence\/ $\{f_j(t)\}_{j=1}^\infty$ is compact for each $t\in T$ and\/ $\limsup_{j\to\infty}N(\vep,f_j,T)0$, then\/ $\{f_j\}_{j=1}^\infty$ contains …
A reliable incremental method of computing the limit load in deformation plasticity based on compliance : Continuous and discrete setting
2016
The aim of this paper is to introduce an enhanced incremental procedure that can be used for the numerical evaluation and reliable estimation of the limit load. A conventional incremental method of limit analysis is based on parametrization of the respective variational formulation by the loading parameter ? ? ( 0 , ? l i m ) , where ? l i m is generally unknown. The enhanced incremental procedure is operated in terms of an inverse mapping ? : α ? ? where the parameter α belongs to ( 0 , + ∞ ) and its physical meaning is work of applied forces at the equilibrium state. The function ? is continuous, nondecreasing and its values tend to ? l i m as α ? + ∞ . Reduction of the problem to a finit…
A pointwise selection principle for metric semigroup valued functions
2008
Abstract Let ∅ ≠ T ⊂ R , ( X , d , + ) be an additive commutative semigroup with metric d satisfying d ( x + z , y + z ) = d ( x , y ) for all x , y , z ∈ X , and X T the set of all functions from T into X . If n ∈ N and f , g ∈ X T , we set ν ( n , f , g , T ) = sup ∑ i = 1 n d ( f ( t i ) + g ( s i ) , g ( t i ) + f ( s i ) ) , where the supremum is taken over all numbers s 1 , … , s n , t 1 , … , t n from T such that s 1 ⩽ t 1 ⩽ s 2 ⩽ t 2 ⩽ ⋯ ⩽ s n ⩽ t n . We prove the following pointwise selection theorem: If a sequence of functions { f j } j ∈ N ⊂ X T is such that the closure in X of the set { f j ( t ) } j ∈ N is compact for each t ∈ T , and lim n → ∞ ( 1 n lim N → ∞ sup j , k ⩾ N , j…