相关论文: Predicted Land\'e $g$-factors for open shell diato…
Two-loop QED corrections with closed fermion loops are calculated for the 1s bound-electron g factor. Calculations are performed to all orders in the nuclear binding strength parameter Z\alpha (where Z is the nuclear charge and \alpha is…
We have performed shell-model calculations starting from the CD-Bonn free nucleon-nucleon NN potential and making use of a new approach for the calculation of the effective interaction. This consists in deriving from the NN potential a…
We present, to the best of our knowledge, the first numerical algorithm for explicit, computable two-sided eigenvalue bounds for Schr\"odinger operators H = -Delta + V on R^N, N = 2,3, in the presence of both an unbounded potential and an…
Using the atomistic tight-binding method in combination with symmetry analysis and extended effective mass theory we derive a phenomenological model for the fine structure of the ground electron and hole states in $[111]$-grown PbX, X=S,Se…
An efficient method, preconditioned conjugate gradient method with a filtering function (PCG-F), is proposed for solving iteratively the Dirac equation in 3D lattice space for nuclear systems. The filtering function is adopted to avoid the…
Development of neutron-rich radioactive beams at the HRIBF facility has stimulated experimental and theoretical activity in heavy Sn and Te isotopes. Recently, the g-factor of the first 2$^+$ state in $^{132}$Te has been measured. We report…
Dynamical mean field theory (DMFT) combined with the local density approximation (LDA) is widely used in solids to predict properties of correlated systems. In this paper, its application to one of the simplest strongly correlated systems,…
The Schrodinger equation for the rotational-vibrational (ro-vibrational) motion of a diatomic molecule with empirical potential functions is solved approximately by means of the Nikiforov-Uvarov method. The approximate ro-vibratinal energy…
Nanowire double quantum dots occupied by an even number of electrons are investigated in the context of energy level structure revealed by electric dipole spin resonance measurements. We use numerically exact configuration interaction…
In some quantum chemical applications, the potential models are linear combination of single exactly solvable potentials. This is the case equivalent of the Stark effect for a charged harmonic oscillator (HO) in a uniform electric field of…
The transient-field technique has been used in both conventional kinematics and inverse kinematics to measure the g factors of the 2+ states in the stable even isotopes of Ru, Pd and Cd. The statistical precision of the g(2+) values has…
In this paper, we solve analytically the Schrodinger equation for s-wave and arbitrary angular momenta with the Hua potential is investigated respectively. The wave function as well as energy equation are obtained in an exact analytical…
The nuclear mean-field potential built up by the $^{12}$C+$^{12}$C interaction at energies relevant for the carbon burning process is calculated in the double-folding model (DFM) using the realistic ground-state density of $^{12}$C and the…
Numerical methods for modeling thin-film magnetization are primarily focused on computing the current density distribution. The highly nonlinear current-voltage characteristic of type-II superconductors significantly complicates the…
Accurate low and high-lying bound states of Tietz-Hua oscillator potential are presented. The radial Schr\"odinger equation is solved efficiently by means of the generalized pseudospectral method that enables optimal spatial discretization.…
The analytic solutions of the spatially-dependent mass Schrodinger equation of diatomic molecules with the centrifugal term l(l+1)/r2 for the generalized q-deformed Morse potential are obtained approximately by means of a parametric…
We report an all-electron, atomic orbital (AO) based, two-component (2C) implementation of the $GW$ approximation (GWA) for closed-shell molecules. Our algorithm is based on the space-time formulation of the GWA and uses analytical…
We derive the Schwinger-Dyson/loop equations for the USp(2k) matrix model which close among the closed and open Wilson loop variables. These loop equations exhibit a complete set of the joining and splitting interactions required for the…
We introduce a machine learning method in which energy solutions from the Schrodinger equation are predicted using symmetry adapted atomic orbitals features and a graph neural-network architecture. \textsc{OrbNet} is shown to outperform…
Purpose: To present a closed formalism calculating charged particle radiation damage induced in DNA. The formalism is valid for all types of charged particles and due to its closed nature is suited to provide fast conversion of dose to…