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The Hamiltonian size reduction method or the mode space method applicable to general heterogeneous structures is developed in this work. The effectiveness and accuracy of the method are demonstrated for four example devices of GaSb/InAs…

Mesoscale and Nanoscale Physics · Physics 2021-09-20 Mincheol Shin

Quantum optimal control theory is becoming increasingly crucial as quantum devices become more precise, but the need to quickly optimize these systems classically remains a significant bottleneck in their operation. Here we present a new…

Quantum Physics · Physics 2022-05-11 Mogens Dalgaard , Felix Motzoi

Gaussian wave packets (GWPs) are well suited as basis functions to describe the time evolution of arbitrary wave functions in systems with nonsingular smooth potentials. They are less so in atomic systems on account of the singular behavior…

Atomic Physics · Physics 2015-05-13 Tomaž Fabčič , Jörg Main , Günter Wunner

We develop a time-dependent, grid-based framework for simulating infrared spectra that is specifically designed for quantum computers. The proposed circuit employs a probabilistic strategy for applying the non-unitary dipole operator and an…

Quantum Physics · Physics 2026-03-24 Xiaoning Feng , Arman Nejad , David P. Tew

The derivation of the time-dependent variational equations of the Multi-Configuration Time-Dependent Hartree (MCTDH) method for high-dimensional quantum propagation is revisited from the perspective of tangent space projection methods. In…

Chemical Physics · Physics 2018-09-27 Matteo Bonfanti , Irene Burghardt

In recent advances in solving the problem of transmission network expansion planning, the use of robust optimization techniques has been put forward, as an alternative to stochastic mathematical programming methods, to make the problem…

Computational Engineering, Finance, and Science · Computer Science 2016-09-28 Roberto Minguez , Raquel Garcia-Bertrand

We introduce a new numerical method for solving time-harmonic acoustic scattering problems. The main focus is on plane waves scattered by smoothly varying material inhomogeneities. The proposed method works for any frequency $\omega$, but…

Numerical Analysis · Mathematics 2022-01-14 Anton Arnold , Sjoerd Geevers , Ilaria Perugia , Dmitry Ponomarev

Homogenization of a thin micro-structure yields effective jump conditions that incorporate the geometrical features of the scatterers. These jump conditions apply across a thin but nonzero thickness interface whose interior is disregarded.…

Computational Physics · Physics 2017-03-08 Bruno Lombard , Agnes Maurel , Jean-Jacques Marigo

Scattering of femtosecond laser pulses on resonant transmission and reflection gratings made of dispersive (Drude metals) and dielectric materials is studied by a time-domain numerical algorithm for Maxwell's theory of linear passive…

Computational Physics · Physics 2009-11-10 Andrei G. Borisov , Sergei V. Shabanov

We present a novel method to simulate the Lindblad equation, drawing on the relationship between Lindblad dynamics, stochastic differential equations, and Hamiltonian simulations. We derive a sequence of unitary dynamics in an enlarged…

Quantum Physics · Physics 2024-08-27 Zhiyan Ding , Xiantao Li , Lin Lin

We present a stochastic method for solving the time-dependent Schr\"odinger equation, generalizing a ground-state full configuration interaction Quantum Monte Carlo method. By performing the time-integration in the complex plane close to…

Strongly Correlated Electrons · Physics 2018-08-08 Kai Guther , Werner Dobrautz , Olle Gunnarsson , Ali Alavi

Digital quantum simulation relies on Trotterization to discretize time evolution into elementary quantum gates. On current quantum processors with notable gate imperfections, there is a critical tradeoff between improved accuracy for finer…

Quantum Physics · Physics 2024-07-09 Hongzheng Zhao , Marin Bukov , Markus Heyl , Roderich Moessner

Quantum systems are exceedingly difficult to engineer because they are sensitive to various types of noises. In particular, time-dependent noises are frequently encountered in experiments but how to overcome them remains a challenging…

Quantum Physics · Physics 2022-05-06 Xiaodong Yang , Xinfang Nie , Tao Xin , Dawei Lu , Jun Li

We present an efficient perturbative method to obtain both static and dynamic polarizabilities and hyperpolarizabilities of complex electronic systems. This approach is based on the solution of a frequency dependent Sternheimer equation,…

Materials Science · Physics 2009-11-13 Xavier Andrade , Silvana Botti , Miguel A. L. Marques , Angel Rubio

We present an algorithm for solving the radiative transfer problem on massively parallel computers using adaptive mesh refinement and domain decomposition. The solver is based on the method of characteristics which requires an adaptive…

Astrophysics of Galaxies · Physics 2015-08-13 Lars Buntemeyer , Robi Banerjee , Thomas Peters , Mikhail Klassen , Ralph E. Pudritz

The accuracy and effectiveness of Hermite spectral methods for the numerical discretization of partial differential equations on unbounded domains, are strongly affected by the amplitude of the Gaussian weight function employed to describe…

Numerical Analysis · Mathematics 2021-04-07 Lorella Fatone , Daniele Funaro , Gianmarco Manzini

Three-dimensional numerical models for underwater sound propagation are popular in computational ocean acoustics. For horizontally slowly varying waveguide environments, an adiabatic mode-parabolic equation hybrid theory can be used for…

Computational Physics · Physics 2024-07-22 Houwang Tu , Yongxian Wang , Xiaolan Zhou , Guojun Xu , Dongbao Gao , Shuqing Ma

Classical simulations of time-dependent quantum systems are widely used in quantum control research. In particular, these simulations are commonly used to host iterative optimal control algorithms. This is convenient for algorithms that are…

Quantum Physics · Physics 2021-11-23 Tyler Jones , Kaiah Steven , Xavier Poncini , Matthew Rose , Arkady Fedorov

Quantum optimal control plays a vital role in many quantum technologies, including quantum computation. One of the most important control parameters to optimise for is the evolution time (pulse duration). However, most existing works focus…

Quantum Physics · Physics 2025-04-02 Minjun Jeon , Zhenyu Cai

We consider the problem of selectively controlling couplings in a practical quantum processor with always-on interactions that are diagonal in the computational basis, using sequences of local NOT gates. This methodology is well-known in…

Quantum Physics · Physics 2020-09-11 Takahiro Tsunoda , Gaurav Bhole , Stephen A. Jones , Jonathan A. Jones , Peter J. Leek