Related papers: Ab initio potential energy surfaces for NH-NH with…
State-of-the-art ab initio techniques have been applied to compute the potential energy curves for the electronic states in the A^1\Sigma_u^+, c^3\Pi_u, and a^3\Sigma_u^+ manifold of the strontium dimer, the spin-orbit and nonadiabatic…
The Kohn variational principle and the (correlated) Hyperspherical Harmonics technique are applied to study the n-3H and p-3He scattering at zero energy. Predictions for the singlet and triplet scattering lengths are obtained for…
We study the thermodynamic limit of the anisotropic XYZ spin chain with non-diagonal integrable open boundary conditions. Although the $U(1)$-symmetry is broken, by using the new parametrization scheme, we exactly obtain the surface energy…
We study the electronic resonant states of H3 with energies above the potential energy surface of the H3+ ground state. These resonant states are important for the dissociative recombination of H3+ at higher collision energies, and previous…
A multilevel approach to sample the potential energy surface in a path integral formalism is proposed. The purpose is to reduce the required number of ab initio evaluations of energy and forces in ab initio path integral molecular dynamics…
Analytic potentials are built for all four $^{2S+1}\Pi_{u/g}$ states of Li$_{2}$ dissociating to Li$(2S)$ + Li$(3P)$: $3b(3^{3}\Pi_{u})$, $3B(3^{1}\Pi_{u})$, $3C(3^{1}\Pi_{g}),$ and $3d(3^{3}\Pi_{g})$. These potentials include the effect of…
The excited electronic states involved in the optical cycle preparation of a pure spin state of the negatively charged NV-defect in diamond are calculated using the HSE06 hybrid density functional and variational optimization of the…
A simple methodology is suggested for the efficient calculation of certain central potentials having singularities. The generalized pseudospectral method used in this work facilitates {\em nonuniform} and optimal spatial discretization.…
We present a six-dimensional potential energy surface for the H2-H2 dimer based on ab initio electronic structure calculations. The surface is intended to describe accurately the bound and quasibound states of the dimers H2-H2, D2-D2, and…
The non-symmetrized hyperspherical harmonics method for a three-body system, composed by two particles having equal masses, but different from the mass of the third particle, is reviewed and applied to the $^3$H, $^3$He nuclei and…
We investigate the spectroscopy and decays of the charmonium and upsilon systems in a potential model consisting of a relativistic kinetic energy term, a linear confining term including its scalar and vector relativistic corrections and the…
In this study, we explore the precise physical quantities in the thermodynamic limit of the one-dimensional Hubbard model with nonparallel boundary magnetic fields based on the off-diagonal Bethe ansatz solution. A particular emphasis is…
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…
We demonstrate that the intricate energy spectrum of neutron-rich helium isotopes can be straightforwardly described by taking advantage of the low-energy properties of neutron-neutron interaction and the scale separation that is present in…
We present our updated results of the nucleon-nucleon potential in quenched lattice QCD simulations with the plaquette gauge action and the Wilson quark action on the 32^4(\simeq (4.4 fm)^4) lattice. From the equal-time Bethe-Salpeter (BS)…
We present a general method for deriving the energy shift of an interacting system of $N$ spinless particles in a finite volume. To this end, we use the nonrelativistic effective field theory (NREFT), and match the pertinent low-energy…
We introduce an orbital free electron density functional approximation based on alchemical perturbation theory. Given convergent perturbations of a suitable reference system, the accuracy of popular self-consistent Kohn-Sham density…
We have used the hyperspherical adiabatic representation to describe the system of three identical bosons in an spin stretched state interacting by an attractive 1/r potential. A proposal has been made how such a system might be realized…
In this article, we investigate the bound state solution of the Klein Gordon equation under mixed vector and scalar coupling of an energy-dependent deformed Hulth\'en potential in D-dimensions. We obtain a transcendental equation after we…
We study the energy-critical nonlinear wave equation in the presence of an inverse-square potential in dimensions three and four. In the defocusing case, we prove that arbitrary initial data in the energy space lead to global solutions that…