相关论文: Benchmark potential energy curve for collinear H$_…
Solving the electronic Schrodinger equation for strongly correlated ground states is a long-standing challenge. We present quantum algorithms for the variational optimization of wavefunctions correlated by products of unitary operators,…
We present numerically exact solutions to the full-dimensional Schrodinger Equation for the few-electron gas (few-EG) model of electronic structure theory. Our core methodology uses a Sum-of-Products (SOP) representation of singular…
Exact solutions of effective radial Schr\"{o}dinger equation are obtained for some inverse potentials by using the point canonical transformation. The energy eigenvalues and the corresponding wave functions are calculated by using a set of…
We have developed a new simple method to build the exact analytical expression of the eigenenergy as a function of the potential. The idea of our method is mainly based on the partitioning of the potential curve, solving the Schr\"odinger…
Recently, the Asymptotic Iteration Method (AIM) was used to calculate the energy spectrum for a short rang three parameter central potential which was introduced by H. Bahlouli and A. D. Alhaidari. The S-orbital wave solution of the…
Energies of the low-lying bound S-states (L=0) of exotic three-body systems, consisting a nuclear core of charge +Ze (Z being atomic number of the core) and two negatively charged valence muons, have been calculated by hyperspherical…
We take an additional step towards the optimization of the novel finite-range pseudopotential at constrained Hartree-Fock-Bogolyubov level and implement an optimization procedure within an axial code using harmonic oscillator basis. We…
The two-dimensional electron-nuclear Schr\"odinger equation using soft-core Coulomb potentials has been a cornerstone for modeling and predicting the behavior of one-active-electron diatomic molecules, particularly for processes where both…
We provide a numerical method for computing solutions to a free boundary problem arising from the equilibrium state of a floating drop. This numerical method is based on a Newton's method for the underlying nonlinear boundary value…
A new solvable hyperbolic single wave potential is found by expanding the regular solution of the 1D Schr\"odinger equation in terms of square integrable basis. The main characteristic of the basis is in supporting an infinite tridiagonal…
The new simple method of the energy reconstruction for a combined calorimeter, which we called the e/h method, is suggested. It uses only the known e/h ratios and the electron calibration constants and does not require the determination of…
We introduce a fully antisymmetrized treatment of three-cluster dynamics within the ab initio framework of the no-core shell model/resonating-group method (NCSM/RGM). Energy-independent non-local interactions among the three nuclear…
In this paper, a quantum dot mathematical model based on a two-dimensional Schr\"odinger equation assuming the 1/r inter-electronic potential is revisited. Generally, it is argued that the solutions of this model obtained by solving a…
In the book the mathematical methods of nuclear cross sections and phases of elastic scattering, energy and characteristics of bound states in two- and three-particle nuclear systems, when the potentials of interaction contain not only…
Relativistic, quantum electrodynamics, as well as non-adiabatic corrections and couplings, are computed for the b $^3\Pi_\mathrm{g}$ and c $^3\Sigma_\mathrm{g}^+$ electronic states of the helium dimer. The underlying Born-Oppenheimer…
We discuss a recent test of the performance of the kinetic energy partition method (KEP) through its application to two separable quantum-mechanical models. We argue that one of the benchmark models is exceedingly simple for testing any…
The Einstein-Podolsky-Rosen~(EPR) model is an analogous model of the anti-ferromagnetic Heisenberg model or the equivalent quantum maximum-cut problem, proposed by R. King two years ago. Adjacent qubits in the model prefer symmetric…
An efficient numerical quadrature is proposed for the approximate calculation of the potential energy in the context of pseudo potential electronic structure calculations with Daubechies wavelet and scaling function basis sets. Our…
The traditional clustering problem of renewable energy profiles is typically formulated as a combinatorial optimization that suffers from the Curse of Dimensionality (CoD) on classical computers. To address this issue, this paper first…
The explicit semiclassical treatment of the logarithmic perturbation theory for the bound-state problem of the radial Shrodinger equation with the screened Coulomb potential is developed. Based upon h-expansions and new quantization…