相关论文: A Simple 'Range Extender' for Basis Set Extrapolat…
The Atom-Calibrated Basis-set Extrapolation (ACBE) method is introduced as a robust approach for extrapolating MP2 correlation energies from small basis sets. Unlike conventional extrapolation techniques, ACBE incorporates system- and…
We have developed and benchmarked a new extended basis set for explicitly correlated calculations, namely cc-pV5Z-F12. It is offered in two variants, cc-pV5Z-F12 and cc- pV5Z-F12(rev2), the latter of which has additional basis functions on…
In this communication we present a method of complete basis set (CBS) extrapolation of correlation energies obtained with a systematic sequence of one-electron basis sets. Instead of fitting the finite-basis results with a certain…
A method is described for the extrapolation of perturbative expansions in powers of asymptotically small coupling parameters or other variables onto the region of finite variables and even to the variables tending to infinity. The method…
A possible solution for the problem of memory-size and computer-time, is the extrapolation of basis-set$^1$. This extrapolation has two exponents $\alpha$ and $\beta$, corresponding to the HF (reference energy) and the energy of…
After recalling the precise existence conditions of the zeta function of a pseudodifferential operator, and the concept of reflection formula, an exponentially convergent expression for the analytic continuation of a multidimensional…
In this paper we consider the variational setting for SPDE on a Gelfand triple $(V, H, V^*)$. Under the standard conditions on a linear coercive pair $(A,B)$, and a symmetry condition on $A$ we manage to extrapolate the classical…
For many physical quantities, theory supplies weak- and strong-coupling expansions of the types $\sum a_n \alpha ^n$ and $ \alpha ^p\sum b_n (\alpha^{-2/q) ^n$, respectively. Either or both of these may have a zero radius of convergence. We…
We investigate a pattern in the $\alpha'$ expansion of tree-level open superstring amplitudes which correlates the appearance of higher depth multiple zeta values with that of simple zeta values in a particular way. We rephrase this…
We present a method to extrapolate nuclear binding energies from known values for neighbouring nuclei. We select four specific mass relations constructed to eliminate smooth variation of the binding energy as function nucleon numbers. The…
For supersymmetric extensions of the Standard Model we construct some expressions that include Yukawa couplings for the third and second generations and receive relatively small quantum corrections. This implies that they slightly depend on…
We study the pole properties of $\Lambda(1405)$ in a model-independent manner by applying the Uniformized Mittag-Leffler expansion proposed in our previous paper. The resonant energy, width and residues are determined by expanding the…
Electronic correlation energies from the random-phase approximation converge slowly with respect to the plane wave basis set size. We study the conditions, under which a short-range local density functional can be used to account for the…
Atomic cluster expansion (ACE) methods provide a systematic way to describe particle local environments of arbitrary body order. For practical applications it is often required that the basis of cluster functions be symmetrized with respect…
We present a novel extrapolation scheme for high order series expansions. The idea is to express the series, obtained in orders of an external variable, in terms of an internal parameter of the system. Here we apply this method to the…
The problem is addressed of defining the values of functions, whose variables tend to infinity, from the knowledge of these functions at asymptotically small variables close to zero. For this purpose, the extrapolation by means of different…
We introduce a new type of cluster expansion which generalizes a previous formula of Brydges and Kennedy. The method is especially suited for performing a phase-space multiscale expansion in a just renormalizable theory, and allows the…
We present a fourfold series expansion representing the Askey-Wilson polynomials. To obtain the result, a sequential use is made of several summation and transformation formulas for the basic hypergeometric series, including the Verma's…
The effects of ground-state correlations on the dipole and quadrupole excitations are studied for $^{40}$Ca and $^{48}$Ca using the extended random phase approximation (ERPA) derived from the time-dependent density-matrix theory. Large…
A systematic analysis of giant quadrupole resonances is performed for several nuclei, from $^{30}$Si to $^{208}$Pb, within the subtracted second random--phase--approximation (SSRPA) model in the framework of the energy--density--functional…