相关论文: Solution of the two-center Dirac equation with 20 …
In this paper, the fractional order curvature equation $(-\Delta)^\gamma u = (1 + \varepsilon K(x))u^{\frac{N + 2\gamma}{N - 2\gamma}}$ in $\mathbb{R}^N$ is considered. Assuming $K(x)$ has two critical points satisfying certain local…
High-precision calculations of the energy levels of the superheavy elements E119 and E120+ are presented. Dominating correlation corrections beyond relativistic Hartree-Fock are included to all orders in the Coulomb interaction using the…
Four-component Dirac Hartree--Fock is an accurate mean-field method for treating molecular systems where relativistic effects are important. However, the computational cost and complexity of the two-electron interaction makes this method…
The model under consideration is an asymmetric two-dimensional Coulomb gas of positively (q_1=+1) and negatively (q_2=-1/2) charged pointlike particles, interacting via a logarithmic potential. This continuous system is stable against…
The numerical analysis for the small amplitude motion of an elastic beam with internal damping is investigated in domain with moving ends. An efficient numerical method is constructed to solve this moving boundary problem. The stability and…
We analyze the spatially semidiscrete piecewise linear finite element method for a nonlocal parabolic equation resulting from thermistor problem. Our approach is based on the properties of the elliptic projection defined by the bilinear…
Solitons of the purely cubic nonlinear Schr\"odinger equation in a space dimension of $n \geq 2$ suffer critical and supercritical collapses. These solitons can be stabilized in a cubic-quintic nonlinear medium. In this paper, we analyze…
We present a study of the two dimensional circular quantum dot model Hamiltonian using a range of quantum chemical ab initio methods. Ground and excited state energies are computed on different levels of perturbation theories including the…
The role of relativistic corrections in Coulomb scattering of heavy ions at intermediate energy collisions ($E_{lab}\gtrsim 50$ MeV/n) is investigated by numerically solving a full set of coupled equations. We compare two methods, (a) one…
Electron removal in collisions of alpha particles with neon dimers is studied using an independent-atom-independent-electron model based on the semiclassical approximation of heavy-particle collision physics. The dimer is assumed to be…
We consider an initial/boundary value problem for one-dimensional fractional-order parabolic equations with a space fractional derivative of Riemann-Liouville type and order $\alpha\in (1,2)$. We study a spatial semidiscrete scheme with the…
The numerical solution of a nonlinear and space-fractional anti-diffusive equation used to model dune morphodynamics is considered. Spatial discretization is effected using a finite element method whereas the Crank-Nicolson scheme is used…
The article considers the successful implementation of relativistic equation-of-motion coupled cluster method for the electron attachment problem (EA-EOMCC) at the level of single- and double- excitation approximation. The implemented…
We have presented the theory, implementation, and benchmark results for the one-electronic variant of spin-free exact two-component (SFX2C1e) linear response coupled cluster (LRCCSD) theory for static and dynamic polarizabilities of atoms…
The Dirac equation for an electron in the central Coulomb field of a point-like nucleus with the charge greater than 137 is considered. This singular problem, to which the fall-down onto the centre is inherent, is addressed using a new…
Considering the elastic scattering of two charged particles, we present two methods for numerically solving the generalized Coulomb-corrected BERW formula with high accuracy across the entire energy spectrum. We illustrate these methods…
Dirac equation for an electron bound by a nucleus in the presence of external axially symmetric field can be solved numerically by using the dual-kinetic-balance conditions imposed on the finite basis set (A-DKB method [Rozenbaum et al,…
Covergent eigensolutions of the Dirac Equation for a relativistic electron in an external Coulomb potential are obtained using the Lanczos Algorithm. A tri-diagonal matrix representation of the Dirac Hamiltonian operator is constructed…
In this article, we present a numerical approach to ensure the preservation of physical bounds on the solutions to linear and nonlinear hyperbolic convection-reaction problems at the discrete level. We provide a rigorous framework for error…
In this paper, we propose a multiphysics finite element method for a nonlinear poroelasticity model. To better describe the processes of deformation and diffusion, we firstly reformulate the nonlinear fluid-solid coupling problem into a…