Related papers: Born-Oppenheimer potential for H$_2$
Within the framework of potential scattering theory we derive an analytical two-potential formula for the on-shell partial wave scattering amplitude. This formula embodies a large number of possible applications, including long range…
We investigate the interaction of ground and excited states of a silver atom with noble gases (NG), including helium. Born-Oppenheimer potential energy curves are calculated with quantum chemistry methods and spin-orbit effects in the…
We analyze the entanglement between electronic and nuclear motions in molecular wave functions, by using different widely used ansatzes in molecular Hamiltonian models (H$^+_2$ in 1D and the Shin-Metiu model); namely, i) Born-Oppenheimer…
The Hamiltonian of an atom with $N$ electrons and a fixed nucleus of infinite mass between two parallel planes is considered in the limit when the distance $a$ between the planes tends to zero. We show that this Hamiltonian converges in the…
The Gildener-Weinberg two-Higgs doublet model (GW-2HDM) provides a naturally light and aligned Higgs boson, $H = H(125)$. It has been studied in the one-loop approximation of its effective potential, $V_1$. An important consequence is that…
In Born-Oppenheimer molecular dynamics (BOMD) simulations based on density functional theory (DFT), the potential energy and the interatomic forces are calculated from an electronic ground state density that is determined by an iterative…
State-of-the-art ab initio techniques have been applied to compute the potential energy surface for the lithium atom interacting with the lithium hydride molecule in the Born-Oppenheimer approximation. The interaction potential was obtained…
For a system of $N$ bosons in one space dimension with two-body $\delta$-interactions the Hamiltonian can be defined in terms of the usual closed semi-bounded quadratic form. We approximate this Hamiltonian in norm resolvent sense by…
We derive an integral equation describing $N$ two-dimensional bosons with zero-range interactions and solve it for the ground state energy $B_N$ by applying a stochastic diffusion Monte Carlo scheme for up to 26 particles. We confirm and go…
Calculations of one-electron spectral functions, optical conductivity and spin-wave energy in the Holstein double-exchange model are made using the many-body coherent potential approximation. Satisfactory agreement is obtained with…
We leverage the power of neural quantum states to describe the ground state wave function of solid and liquid atomic hydrogen, including both electronic and protonic degrees of freedom. For static protons, the resulting Born-Oppenheimer…
Bohr's model agreed with the hydrogen spectrum results, but did not agree with the spectrum of Helium. Here we show that Bohr's model-based methods can calculate the experimental value (-79.005 eV) of Helium ground state energy correctly.…
Consider the Schr\"odinger operators $H_{\pm}=-d^2/dx^2\pm V(x)$. We present a method for estimating the potential in terms of the negative eigenvalues of these operators. Among the applications are inverse Lieb-Thirring inequalities and…
The Brueckner G-matrix for a slab of nuclear matter is analyzed in the singlet $^1S$ and triplet $^3S+^3D$ channels. The complete Hilbert space is split into two domains, the model subspace $S_0$, in which the two-particle propagator is…
In this work we investigate small clusters of bosons using the hyperspherical harmonic basis. We consider systems with $A=2,3,4,5,6$ particles interacting through a soft inter-particle potential. In order to make contact with a real system,…
The on-shell self-energy of the homogeneous electron gas in second order of exchange, $\Sigma_{2{\rm x}}= {\rm Re} \Sigma_{2{\rm x}}(k_{\rm F},k_{\rm F}^2/2)$, is given by a certain integral. This integral is treated here in a similar way…
Simple analytic formulas are considered for the energy radiated in low frequency bremsstrahlung from fully ionized gases. A formula that has been frequently cited over many years turns out to have only a limited range of validity, more…
The exchange-only optimized effective potential method is implemented with the use of Slater-type basis functions, seeking for an alternative to the standard methods of solution with some computational advantages. This procedure has been…
A simple analytical expression, which closely approximates the Coulomb potential between two uniformly charged spheres, is presented. This expression can be used in the optical potential semiclassical analyses which require that the…
We consider the inhomogeneous nonlinear Schr\"odinger equation with inverse-square potential in $\mathbb{R}^N$ $$ i u_t + \mathcal{L}_a u+\lambda |x|^{-b}|u|^\alpha u = 0,\;\;\mathcal{L}_a=\Delta -\frac{a}{|x|^2}, $$ where $\lambda=\pm1$,…