Related papers: A Simple 'Range Extender' for Basis Set Extrapolat…
Let $m\geq 3$, we prove that $(\alpha n^\theta \mod 1)_{n>0}$ has Poissonian $m$-point correlation for all $\alpha>0$, provided $\theta<\theta_m$, where $\theta_m$ is an explicit bound which goes to $0$ as $m$ increases. This work builds on…
Assume that $X$ is a connected $(q+1)$-regular undirected graph of finite order $n$. Let $A$ denote the adjacency matrix of $X$. Let $\lambda_1=q+1>\lambda_2\geq \lambda_3\geq \ldots \geq \lambda_n$ denote the eigenvalues of $A$. The…
We derive the equations to calculate the reduced width amplitudes (RWA) of the different size clusters and deformed clusters without any approximation. These equations named Laplace expansion method are applicable to the nuclear models…
The derivation of Marko and Siggia's interpolation formula for the force-extension relation of the Worm-Like Chain Model (C.Bustamante, J.F.Marko, E.D.Siggia, and S.Smith, Science Vol.265, p.1599 (1994); J.F.Marko and E.D.Siggia,…
Any optical structure possesses resonance modes and its response to an excitation can be decomposed onto the quasinormal and numerical modes of discretized Maxwell's operator. In this paper, we consider a dielectric permittivity that is a…
An extensive analysis has been carried out of the performance of standard families of basis sets with the hierarchy of coupled cluster methods CC2, CCSD, CC3 and CCSDT in computing selected Oxygen, Carbon and Nitrogen K-edge (vertical) core…
Weak-coupling expansions (conserving approximations) are carried out for the attractive Holstein and Hubbard models (on an infinite-dimensional hypercubic lattice) that include all bandstructure and vertex correction effects. Quantum…
The problem of extrapolating asymptotic perturbation-theory expansions in powers of a small variable to large values of the variable tending to infinity is investigated. The analysis is based on self-similar approximation theory. Several…
The coupling parameter expansion in thermodynamic perturbation theory of simple fluids is generalized to include the derivatives of bridge function. We applied seventh order version of the theory to Square-Well (SW) and Lennard-Jones (LJ)…
Uniform asymptotic expansions are derived for Whittaker's confluent hypergeometric functions $M_{\kappa,\mu}(z)$ and $W_{\kappa,\mu}(z)$, as well as the numerically satisfactory companion function $W_{-\kappa,\mu}(ze^{-\pi i})$. The…
The self-energy and vertex QED radiative corrections to the parity nonconservation (PNC) amplitude in atoms are obtained using the perturbation theory in powers of (alpha Z). The calculated linear in (alpha Z) term gives -0.6 % for the PNC…
In this paper, an equivalence between existence of particular exponential Riesz bases for multivariate bandlimited functions and existence of certain polynomial interpolants for these bandlimited functions is given. For certain classes of…
Basis set convergence of the Hartree-Fock and the correlation energy is examined for the hydrogen bonded infinite bent chains (HF)_infinity and (HCl)_infinity. We employ series of correlation consistent basis sets up to quintuple zeta…
In this updated and expanded version of our delayed Comment we show that the np backward cross section, as presented by the Uppsala group, is seriously flawed (more than 25 sd.). The main reason is the incorrect normalization of the data.…
We calculate the parity non-conserving (PNC) electric-dipole ($E1$) transition amplitudes for the $5s - 6s$ and $5s - 4d_{3/2}$ transitions in Rb and Sr$^+$. Our results include both the nuclear-spin-independent and nuclear-spin-dependent…
The asymptotic behavior of solutions to the second-order linear differential equation $d^{2}w/dz^{2}=\{u^{2}f(\alpha,z)+g(z)\}w$ is analyzed for a large real parameter $u$ and $\alpha\in[0,\alpha_{0}]$, where $\alpha_{0}>0$ is fixed. The…
The multipole expansion is a key tool in the study of light-matter interactions. All the information about the radiation of and coupling to electromagnetic fields of a given charge-density distribution is condensed into few numbers: The…
We address the efficient computation of power-law-based interaction potentials of homogeneous $d$-dimensional bodies with an infinite $n$-dimensional array of copies, including their higher-order derivatives. This problem forms a serious…
The two-site single-polaron problem is studied within the perturbative expansions using different standard phonon basis obtained through the Lang Firsov (LF), modified LF (MLF) and modified LF transformation with squeezed phonon states…
Perturbation expansions up to third order for the generalized spiked harmonic oscillator Hamiltonians H = -d^2/dx^2+ x^2 + A/x^2 + lambda/x^alpha, A >= 0, 2gamma > alpha, gamma=1+(1/2)sqrt(1+4A), and small values of the coupling lambda > 0,…