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We propose a multi-particle self-consistent Hamiltonian (derived from an N-body description) that is applicable for periodic structures such as traveling-wave tubes (TWTs), gyrotrons, free-electron lasers, or particle accelerators. We build…

The resistivity of two-dimensional (2D) metals generally exhibits insensitivity to electron-electron scattering. However, it's worth noting that Galilean invariance may not hold true in systems characterized by a spectrum containing…

Mesoscale and Nanoscale Physics · Physics 2024-05-06 A. D. Levin , G. M. Gusev , F. G. G. Hernandez , E. B. Olshanetsky , V. M. Kovalev , M. V. Entin , N. N. Mikhailov

We use the recently-developed Heat-bath Configuration Interaction (HCI) algorithm as an efficient active-space solver to perform multi-configuration self-consistent field calculations (HCISCF) with large active spaces. We give a detailed…

Chemical Physics · Physics 2018-11-08 James E. T. Smith , Adam A. Holmes , Bastien Mussard , Sandeep Sharma

Time-independent gauge transformations are implemented in the canonical formalism by the Gauss law which is not covariant. The covariant form of Gauss law is conceptually important for studying asymptotic properties of the gauge fields. For…

High Energy Physics - Theory · Physics 2017-09-13 A. P. Balachandran , Arshad Momen , Amilcar R. de Queiroz

Quantum-simulator hardware promises new insights into problems from particle and nuclear physics. A major challenge is to reproduce gauge invariance, as violations of this quintessential property of lattice gauge theories can have dramatic…

Quantum Physics · Physics 2022-12-07 Jad C. Halimeh , Haifeng Lang , Julius Mildenberger , Zhang Jiang , Philipp Hauke

We demonstrate a method for determining the three-dimensional location of single atoms in a quantum gas microscopy system using a phase-only spatial light modulator to modify the point-spread function of the high-resolution imaging system.…

We lay out an experiment to realize time-reversal invariant topological insulators in alkali atomic gases. We introduce an original method to synthesize a gauge field in the near-field of an atom-chip, which effectively mimics the effects…

We propose schemes to design and control a time-dependent decoherence-free subspace (DFS) in a dissipative atom-cavity system. These schemes use atoms with three internal energy levels, which allows for the DFS to be multi-dimensional--a…

The study of the continuum radiative transfer problem inside circumstellar envelopes is both a theoretical and numerical challenge, especially in the frequency-dependent and multi-dimensional case. While approximate methods are easier to…

Solar and Stellar Astrophysics · Physics 2024-10-14 J. Perdigon , M. Faurobert , G. Niccolini

We investigate gauge invariance against phase space shifting in nonequilibrium systems, as represented by time-dependent many-body Hamiltonians that drive an initial ensemble out of thermal equilibrium. The theory gives rise to gauge…

Statistical Mechanics · Physics 2025-04-25 Johanna Müller , Florian Sammüller , Matthias Schmidt

We present a model which describes coherent and incoherent processes in continuous-variable atom-light interfaces. We assume Gaussian states for light and atoms and formulate the system dynamics in terms of first and second moments of the…

Quantum Physics · Physics 2008-02-22 M. Koschorreck , M. W. Mitchell

We present the fully general time-dependent multiconfiguration self-consistent-field method to describe the dynamics of a system consisting of arbitrary different kinds and numbers of interacting fermions and bosons. The total wave function…

Atomic Physics · Physics 2017-10-11 Ryoji Anzaki , Takeshi Sato , Kenichi L. Ishikawa

In parallel with the evolution of femtosecond and attosecond laser as well as free-electron laser technology, a variety of theoretical methods have been developed to describe the behavior of atoms, molecules, clusters, and solids under the…

Atomic Physics · Physics 2015-11-12 Kenichi L. Ishikawa , Takeshi Sato

We investigate configuration-interaction (CI) calculations on a basis of molecular orbitals generated by preliminary density-functional theory (DFT) calculations. We use this CI/DFT framework to improve the modeling of core-excited states…

Chemical Physics · Physics 2025-09-11 Giorgio Visentin , Francois Mauger

We present a low-space overhead simulation algorithm based on the truncated Dyson series for time-dependent quantum dynamics. This algorithm is applied to simulating time-independent Hamiltonians by transitioning to the interaction picture,…

Quantum Physics · Physics 2019-06-07 Guang Hao Low , Nathan Wiebe

In this paper, a third order gas kinetic scheme is developed on the three dimensional hybrid unstructured meshes for the numerical simulation of compressible inviscid and viscous flows. A third-order WENO reconstruction is developed on the…

Numerical Analysis · Mathematics 2022-04-18 Yaqing Yang , Liang Pan , Kun Xu

A collection of trapped atomic ions represents one of the most attractive platforms for the quantum simulation of interacting spin networks and quantum magnetism. Spin-dependent optical dipole forces applied to an ion crystal create…

A conceptually simple model for strongly interacting compact U(1) lattice gauge theory is expressed as operators acting on qubits. The number of independent gauge links is reduced to its minimum through the use of Gauss's law. The model can…

High Energy Physics - Lattice · Physics 2019-05-24 Randy Lewis , R. M. Woloshyn

Our main interest here is to analyze the gauge invariance issue concerning the noncommutative relativistic particle. Since the analysis of the constraint set from Dirac's point of view classifies it as a second-class system, it is not a…

High Energy Physics - Theory · Physics 2018-01-17 Everton M. C. Abreu , Cresus F. L. Godinho

Diffusion models have demonstrated remarkable success in various domains, including molecular generation. However, conditional molecular generation remains a fundamental challenge due to an intrinsic trade-off between targeting specific…

Machine Learning · Computer Science 2024-11-04 Hojung Jung , Youngrok Park , Laura Schmid , Jaehyeong Jo , Dongkyu Lee , Bongsang Kim , Se-Young Yun , Jinwoo Shin
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