Related papers: An HFB scheme in natural orbitals
A simple approximation within the framework of the hybrid methods for the calculation of the electronic structure of solids is presented. By considering only the diagonal elements of the perturbation operator (Hartree-Fock exchange minus…
We propose a new method to solve the Hartree-Fock-Bogoliubov equations for weakly bound nuclei, which works for both spherical and axially deformed cases. In this approach, the quasiparticle wave functions are expanded in a complete set of…
For any orthogonal polynomials system on real line we construct an appropriate oscillator algebra such that the polynomials make up the eigenfunctions system of the oscillator hamiltonian. The general scheme is divided into two types: a…
We present new formulae for the matrix elements of one-body and two-body physical operators in compact forms, which are applicable to arbitrary Hartree-Fock-Bogoliubov wave functions, including those for multi-quasiparticle excitations. The…
The aim of this work is to extend the deformed relativistic Hartree-Bogoliubov theory in continuum (DRHBc) based on the point-coupling density functionals to odd-$A$ and odd-odd nuclei and examine its applicability by taking odd-$A$ Nd…
We present a method to approximate post-Hartree-Fock correlation energies by using approximate natural orbitals obtained by the random phase approximation (RPA). We demonstrate the method by applying it to the helium atom, the hydrogen and…
We present a real-space spectral method for computing the orbital magnetization of crystals. Starting from the commutator form of the orbital magnetization operator, we formulate an energy-resolved spectral function that is amenable to…
We show that nontrivial solutions to higher and fractional order equations with certain nonlinearity are radially symmetric and nonincreasing on geodesic balls in the hyperbolic space $\mathbb{H}^n$ as well as on the entire space…
Using the $\hbar$-expansion of the Green's function of the Hartree-Fock-Bogoliubov equation, we extend the second-order Thomas-Fermi approximation to generalized superfluid Fermi systems by including the density-dependent effective mass and…
We investigate the ground states of neutron stars and white dwarfs in the Hartree-Fock (HF) and Hartree-Fock-Bogoliubov (HFB) theories. It is known that the system is stable below a critical mass, which depends on the gravitational…
We present a second-order-in-time finite difference scheme for the Cahn-Hilliard-Hele-Shaw equations. This numerical method is uniquely solvable and unconditionally energy stable. At each time step, this scheme leads to a system of…
In this paper we present a computer-assisted procedure for proving the existence of transverse heteroclinic orbits connecting hyperbolic equilibria of polynomial vector fields. The idea is to compute high-order Taylor approximations of…
We show that the Hartree-Fock-Bogoliubov (HFB) method is able to describe experimental values of alpha decay widths by including a residual nucleon-nucleon Surface Gaussian Interaction (SGI) within the standard procedure used to calculate…
We present a purely numerical approach in Cartesian grid, for efficient computation of Hartree-Fock (HF) exchange contribution in the HF and density functional theory models. This takes inspiration from a recently developed algorithm [Liu…
We propose a general scheme for separation of variables in the integrable Hamiltonian systems on orbits of the loop algebra $\mathfrak{sl}(2,\Complex)\times \mathcal{P}(\lambda,\lambda^{-1})$. In particular, we illustrate the scheme by…
Few-electron systems confined in two-dimensional parabolic quantum dots at high magnetic fields are studied by the Hartree-Fock (HF) and exact diagonalization methods. A generalized multicenter Gaussian basis is proposed in the HF method. A…
A new theoretical approach is presented that combines the Hartree-Fock variational scheme with the exact solution of the pairing problem in the finite orbital space. Using this formulation in the sd-space as an example, we show that the…
We present a method for optimal coordination of multiple vehicle teams when multiple endpoint configurations are equally desirable, such as seen in the autonomous assembly of formation flight. The individual vehicles' positions in the…
The Skyrme-Hartree-Fock-Bogoliubov code HFBTHO using the axial (2D) Transformed Harmonic Oscillator basis is tested against the HFODD (3D Cartesian HO basis) and HFBRAD (radial coordinate) codes. Results of large-scale ground-state…
Recently, the efficient numerical solution of Hamiltonian problems has been tackled by defining the class of energy-conserving Runge-Kutta methods named Hamiltonian Boundary Value Methods (HBVMs). Their derivation relies on the expansion of…