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A two-dimensional, fully numerical approach to the solution of four-component Dirac-Fock equation using the moderately long Hermitian basis of B-splines is applied to H, H2+ and H2 in a strong magnetic field. The geometric parameters,…
A formally exact discrete multi-resolution representation of quantum field theory on a light front is presented. The formulation uses an orthonormal basis of compactly supported wavelets to expand the fields restricted to a light front. The…
To perform efficient many-body calculations in the framework of the exact diagonalization of the Hamiltonian one needs an appropriately tailored Fock basis built from the single-particle orbitals. The simplest way to compose the basis is to…
A multi-configuration mixing approach built on essentially complex, symmetry-projected Hartree-Fock-Bogoliubov (HFB) mean fields is introduced. The mean fields are obtained by variation after projection. The configuration space consists out…
We provide a formulation of quantum mechanics based on the cohomology of the Batalin-Vilkovisky (BV) algebra. Focusing on quantum-mechanical systems without gauge symmetry we introduce a homotopy retract from the chain complex of the…
We construct a fully self-consistent Hartree-Fock-Bogoliubov theory that describes a spinless Fermi gas with long-range interaction. We apply this theory to a system of uniform dipolar fermionic polar molecules, which has attracted much…
We show how to derive an effective nonlinear dynamics, described by the Hartree-Fock equations, for fermionic quantum particles confined to a two-dimensional box and in presence of an external, uniform magnetic field. The derivation invokes…
We develop a new method of implementing the Hartree-Fock calculations. A class of Gaussian bases is assumed, which includes the Kamimura-Gauss basis-set as well as the set equivalent to the harmonic-oscillator basis-set. By using the…
We describe the new version (v2.73y) of the code HFODD which solves the nuclear Skyrme Hartree-Fock or Skyrme Hartree-Fock-Bogolyubov problem by using the Cartesian deformed harmonic-oscillator basis. In the new version, we have implemented…
Silicon quantum computing has the potential to revolutionize technology with capabilities to solve real-life problems that are computationally complex or even intractable for modern computers [1] by offering sufficient high quality qubits…
The Lee-Wick models are higher-derivative theories that are claimed to be unitary thanks to a peculiar cancelation mechanism. In this paper, we provide a new formulation of the models, to clarify several aspects that have remained quite…
We prove the existence of minimizers for Hartree-Fock-Bogoliubov (HFB) energy functionals with attractive two-body interactions given by Newtonian gravity. This class of HFB functionals serves as model problem for self-gravitating…
Long-range effective methods are ubiquitous in physics and in quantum theory, in particular. Furthermore, the reliability of such methods is higher when the nature of short-ranged interactions need not be modeled explicitly. This may be…
In the limit of infinite spatial dimensions a thermodynamically consistent theory, which is valid for arbitrary value of the Coulombic interaction ($U<\infty$), is built for the Hubbard model when the total auxiliary single-site problem…
We introduce an energy functional for ground-state electronic structure calculations. Its variables are the natural spin-orbitals of singlet many-body wave functions and their joint occupation probabilities deriving from controlled…
In this thesis, the quantum Hamilton Jacobi (QHJ) formalism is used to study various exactly solvable (ES) and quasi -exactly solvable (QES) models. Using this method, we obtain the bound state eigenvalues and the eigenfunctions for the…
Deep neural networks have become a highly accurate and powerful wavefunction ansatz in combination with variational Monte Carlo methods for solving the electronic Schr\"odinger equation. However, despite their success and favorable scaling,…
We give a uniform realization of the minimal representation of a double cover of the conformal group SO(2,n+1)_0 in the kernel of the wave operator on flat Minkowski space as a positive energy representation H^+ for n even and odd. Using…
A recently developed finite element approach for fully numerical atomic structure calculations [S. Lehtola, Int. J. Quantum Chem. 119, e25945 (2019)] is extended to the description of atoms with spherically symmetric densities via…
We present a quantum algorithmic framework for simulating linear, anti-Hermitian (lossless) wave equations in heterogeneous, anisotropic, and time-independent media. This framework encompasses a broad class of wave equations, including the…