Related papers: Quasi-diagonal Inhomogeneous Closure for Classical…
We describe the behavior of the Perdew-Zunger self-interaction-corrected local density approximation (SIC-LDA) functional when implemented in a plane-wave pseudopotential formalism with Wannier functions. Prototypical semiconductors and…
We develop a formalism for the robust dynamical decoupling and Hamiltonian engineering of strongly interacting qudit systems. Specifically, we present a geometric formalism that significantly simplifies qudit pulse sequence design, while…
Often quantum systems are not isolated and interactions with their environments must be taken into account. In such open quantum systems these environmental interactions can lead to decoherence and dissipation, which have a marked influence…
The QCD gluon equation of motion is solved approximately by means of the Green function. This solution is used to reformulate the Lagrangian of QCD such that the gluon propagator appears directly in the interaction terms of the Lagrangian.…
We show that the standard Heisenberg algebra of quantum mechanics admits a noncommutative differential calculus $\Omega^1$ depending on the Hamiltonian $p^2/2m + V(x)$, and a flat quantum connection $\nabla$ with torsion such that a…
The dynamics of classical and quantum systems which are driven by a high frequency ($\omega$) field is investigated. For classical systems the motion is separated into a slow part and a fast part. The motion for the slow part is computed…
Hexagon relations are combinatorial or algebraic realizations of four-dimensional Pachner moves. We introduce some simple set-theoretic hexagon relations and then `quantize' them using what we call `polynomial hexagon cohomologies'. Based…
Self-interaction error (SIE), arising from the imperfect cancellation of the spurious classical Coulomb interaction between an electron and itself, is a persistent challenge in modern density functional approximations. This issue is…
We analyze the behavior of quantum dynamical entropies production from sequences of quantum approximants approaching their (chaotic) classical limit. The model of the quantized hyperbolic automorphisms of the 2-torus is examined in detail…
The classical approximation provides a non-perturbative approach to time-dependent problems in finite temperature field theory. We study the divergences in hot classical field theory perturbatively. At one-loop, we show that the linear…
Quantum computation appears to offer significant advantages over classical computation and this has generated a tremendous interest in the field. In this thesis we consider the application of quantum computers to scientific computing and…
The classical Hamilton equations of motion yield a structure sufficiently general to handle an almost arbitrary set of ordinary differential equations. Employing elementary algebraic methods, it is possible within the Hamiltonian structure…
Inhomogeneous quantum annealing (IQA), in which transverse fields are turned off one by one rather than simultaneously, has been proposed as an effective way to avoid the first-order phase transitions that impede conventional quantum…
In this paper, the Higgs-like approach is used to analyze the quantum dynamics of a harmonic oscillator constrained on a circle. We obtain the Hamiltonian of this system as a function of the Cartesian coordinate of the tangent line through…
An iterative orbital interaction (iOI) approach is proposed to solve, in a bottom-up fashion, the self-consistent field problem in quantum chemistry. While it belongs grossly to the family of fragment-based quantum chemical methods, iOI is…
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…
A consistent description of interactions between classical and quantum systems is relevant to quantum measurement theory, and to calculations in quantum chemistry and quantum gravity. A solution is offered here to this longstanding problem,…
We introduce an application of the Quasi-Gasdynamic method for a solution of ideal magnetohydrodynamic equations in the modeling of compressible conductive gas flows. A time-averaging procedure is applied for all physical parameters in…
The Dirac method is used to analyze the classical and quantum dynamics of a particle constrained on a circle. The method of Lagrange multipliers is scrutinized, in particular in relation to the quantization procedure. Ordering problems are…
We propose a hybrid quantum-classical algorithm for approximating the ground state and ground state energy of a Hamiltonian. Once the Ansatz has been decided, the quantum part of the algorithm involves the calculation of two overlap…