相关论文: Calculation of low-lying energy levels in quantum …
Approximating ground and a fixed number of excited state energies, or equivalently low order Hamiltonian eigenvalues, is an important but computationally hard problem. Typically, the cost of classical deterministic algorithms grows…
A powerful method for calculating the eigenvalues of a Hamiltonian operator consists of converting the energy eigenvalue equation into a matrix equation by means of an appropriate basis set of functions. The convergence of the method can be…
We generalize a recently proposed small-energy expansion for one-dimensional quantum-mechanical models. The original approach was devised to treat symmetric potentials and here we show how to extend it to non-symmetric ones. Present…
Accurate computation of multiple eigenvalues of quantum Hamiltonians is essential in quantum chemistry, materials science, and molecular spectroscopy. Estimating excited-state energies is challenging for classical algorithms due to…
Quantum mechanics has about a dozen exactly solvable potentials. Normally, the time-independent Schroedinger equation for them is solved by using a generalized series solution for the bound states (using the Froebenius method) and then an…
In 2011, the fundamental gap conjecture for Schr\"odinger operators was proven. This can be used to estimate the ground state energy of the time-independent Schr\"odinger equation with a convex potential and relative error \epsilon.…
Accurately solving the Schr\"odinger equation remains a central challenge in computational physics, chemistry, and materials science. Here, we propose an alternative eigenvalue problem based on a system's autocorrelation function, avoiding…
A numerical method for solving Schrodinger's equation based upon a Baker-Campbell-Hausdorff (BCH) expansion of the time evolution operator is presented herein. The technique manifestly preserves wavefunction norm, and it can be applied to…
This paper addresses the problem of computing the eigenvalues lying in the gaps of the essential spectrum of a periodic Schrodinger operator perturbed by a fast decreasing potential. We use a recently developed technique, the so called…
The analytical transfer matrix technique is applied to the Schr\"{o}dinger equation of symmetric quartic-well potential problem in the form $V(x)={1/2}kx^{2}+\lambda{x^{4}}.$ This gives quantization condition from which we can calculate the…
For a quantum mechanical system with broken supersymmetry, we present a simple method of determining the ground state when the corresponding energy eigenvalue is sufficiently small. A concise formula is derived for the approximate ground…
We review a new iterative procedure to solve the low-lying states of the Schroedinger equation, done in collaboration with Richard Friedberg. For the groundstate energy, the $n^{th}$ order iterative energy is bounded by a finite limit,…
Energy levels of neutral atoms have been re-examined by applying an alternative perturbative scheme in solving the Schrodinger equation for the Yukawa potential model with a modified screening parameter. The predicted shell binding energies…
This paper describes a new numerical method for solving eigenstate problems, such as time-independent Schrodinger equation. The idea is to use the first order perturbation theory to rewrite the eigenvalue problem as a system of first order…
We revisit the problem posed by an anharmonic oscillator with a potential given by a polynomial function of the coordinate of degree six that depends on a parameter $\lambda $. The ground state can be obtained exactly and its energy…
Estimating the ground state energy of a multiparticle system with relative error $\e$ using deterministic classical algorithms has cost that grows exponentially with the number of particles. The problem depends on a number of state…
We propose an approximate solution of the time-dependent Schr\"odinger equation using the method of stationary states combined with a variational matrix method for finding the energies and eigenstates. We illustrate the effectiveness of the…
We apply high-order many-body perturbation theory for the calculation of ground-state energies of closed-shell nuclei using realistic nuclear interactions. Using a simple recursive formulation, we compute the perturbative energy…
The convergent iterative procedure for solving the groundstate Schroedinger equation is extended to derive the excitation energy and the wave function of the low-lying excited states. The method is applied to the one-dimensional quartic…
This report discusses two new ideas for using perturbation methods to solve the time-independent Schr\"odinger equation. The first concept begins with rewriting the perturbation equations in a form that is closely related to matrix…