Related papers: Refining spectroscopic calculations for trivalent …
An ab initio Hartree-Fock approach aimed at directly obtaining the localized orthogonal orbitals (Wannier functions) of a crystalline insulator is described in detail. The method is used to perform all-electron calculations on the ground…
We had previously obtained an integral equation for mesons in transverse lattice QCD, in the limit of large number of colours and strong transverse lattice gauge coupling [1]. This equation is a generalisation of the 't Hooft equation [2],…
We present an efficient method for estimating the eigenvalues of a Hamiltonian $H$ from the expectation values of the evolution operator for various times. For a given quantum state $\rho$, our method outputs a list of eigenvalue estimates…
Using the modified Prelle- Singer approach, we point out that explicit time independent first integrals can be identified for the damped linear harmonic oscillator in different parameter regimes. Using these constants of motion, an…
We present a method to compute the photoionization spectra of atoms and molecules in linear response time-dependent density functional theory. The electronic orbital variations corresponding to ionized electrons are expanded on a basis set…
Transition amplitudes and transition probabilities are relevant to many areas of physics simulation, including the calculation of response properties and correlation functions. These quantities can also be related to solving linear systems…
We extend the formalism based on perturbative QCD that was developed in our previous work, and compute the hyperfine splittings of the bottomonium spectrum as well as the fine and hyperfine splittings of the charmonium spectrum. All the…
In this work, the controversy between the interpretations of recent measurements on dense aluminum plasma created with Linac coherent light sources (LCLS) X-ray free electron laser (FEL) and Orion laser has been addressed. In both kind of…
By substituting the diagonal and the other two adjacent diagonals terms with two different functions depending on two parameters of the discrete Laplacian operator, the nature of its spectrum changes from being purely continuous to…
We consider a family of discrete Jacobi operators on the one-dimensional integer lattice with Laplacian and potential terms modulated by a primitive invertible two-letter substitution. We investigate the spectrum and the spectral type, the…
We have investigated energies, magnetic dipole hyperfine structure constants ($A_{hyf}$) and electric dipole (E1) matrix elements of a number of low-lying states of the triply ionized tin (Sn$^{3+}$) by employing relativistic…
Lepage's improvement scheme is a recent major progress in lattice $QCD$, allowing to obtain continuum physics on very coarse lattices. Here we discuss improvement in the Hamiltonian formulation, and we derive an improved Hamiltonian from a…
DFT+U provides a convenient, cost-effective correction for the self-interaction error (SIE) that arises when describing correlated electronic states using conventional approximate density functional theory (DFT). The success of a DFT+U(+J)…
We have studied a three-level {\Lambda}-type atomic system with all the energy levels exhibiting decay. The system is described by a pseudo-Hermitian Hamiltonian and subject to certain conditions, the Hamiltonian shows parity-time (PT)…
The spectrum of excitations of triply-charmed baryons is computed using lattice QCD including dynamical light quark fields. Calculations are performed on anisotropic lattices with temporal and spatial spacings a_t = 0.0351(2) and a_s ~ 0.12…
The q-deformed harmonic oscillator is studied in the light of q-deformed phase space variables. This allows a formulation of the corresponding Hamiltonian in terms of the ordinary canonical variables $x$ and $p$. The spectrum shows…
In this work we investigate $q{\bar q}$ spectra and wavefunctions of light front transverse lattice Hamiltonians that result from different methods of formulating fermions on the transverse lattice. We adopt the one link approximation for…
We present a self-contained operator-based approach to derive the spectrum of trapped ions. This approach provides the complete normal form of the low energy quadratic Hamiltonian in terms of bosonic phonons, as well as an effective free…
In a recent paper, Tayal et al. [{\em Astrophys. J. Suppl.} {\bf 2019}, {\emph 242}, 9] have reported results for energy levels, radiative rates (A-values) and effective collision strengths ($\Upsilon$) for transitions among the 198 levels…
Many shape analysis methods treat the geometry of an object as a metric space that can be captured by the Laplace-Beltrami operator. In this paper, we propose to adapt the classical Hamiltonian operator from quantum mechanics to the field…