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Applications of quantum simulation algorithms to obtain electronic energies of molecules on noisy intermediate-scale quantum (NISQ) devices require careful consideration of resources describing the complex electron correlation effects. In…

Quantum Physics · Physics 2020-04-17 Mekena Metcalf , Nicholas P. Bauman , Karol Kowalski , Wibe A. de Jong

Validity of fluid models breaks down for non-thermal or weakly collisional plasmas which often occur e.g. in the solar wind. In these regimes one has to resort to modelling through the first-principle Vlasov-Maxwell system, but its…

Plasma Physics · Physics 2025-12-01 Rostislav-Paul Wilhelm , Fabio Bacchini

Manufacturers have been developing new graphics processing unit (GPU) nodes with large capacity, high bandwidth memory and very high bandwidth intra-node interconnects. This enables moving large amounts of data between GPUs on the same node…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-11-29 Mino Woo , Terry Jordan , Tarak Nandi , Jean Francois Dietiker , Christopher Guenther , Dirk Van Essendelft

A new simulation technique to obtain the synchronized steady-state solutions existing in coupled oscillator systems is presented. The technique departs from a semi-analytical formulation presented in previous works. It extends the model of…

Systems and Control · Electrical Eng. & Systems 2024-04-22 Pedro Umpierrez , Victor Arana , Sergio Sancho

Markov Chain Monte Carlo (MCMC) algorithms are standard approaches to solve imaging inverse problems and quantify estimation uncertainties, a key requirement in absence of ground-truth data. To improve estimation quality, Plug-and-Play MCMC…

Methodology · Statistics 2025-11-04 Maxime Bouton , Pierre-Antoine Thouvenin , Audrey Repetti , Pierre Chainais

This work proposes a deep learning-based emulator for the efficient computation of the coupled viscous Burgers' equation with random initial conditions. In a departure from traditional data-driven deep learning approaches, the proposed…

Computational Physics · Physics 2022-02-24 Xihaier Luo , Yihui Ren , Wei Xu , Shinjae Yoo , Balasubramanya Nadiga , Ahsan Kareem

We have developed an application and implemented parallel algorithms in order to provide a computational framework suitable for massively parallel supercomputers to study the unitary dynamics of quantum systems. We use renowned parallel…

Computational Physics · Physics 2018-11-20 Marlon Brenes , Vipin Kerala Varma , Antonello Scardicchio , Ivan Girotto

Simulating nonlinear partial differential equations (PDEs) such as the Navier--Stokes (NS) equations remains computationally intensive, especially when implicit time integration is used to capture multiscale flow dynamics. This work…

Fluid Dynamics · Physics 2025-08-29 Shaobo Yao , Zhiyu Duan , Ziteng Wang , Wenwen Zhao , Shiying Xiong

An optimization algorithm for a group of nonsmooth nonconvex problems inspired by two-stage stochastic programming problems is proposed. The main challenges for these problems include (1) the problems lack the popular lower-type properties…

Optimization and Control · Mathematics 2022-04-01 Jingyi Wang , Cosmin G. Petra

The integration of Inverter-Based Resource (IBR) model into phasor-domain short circuit (SC) solvers challenges their numerical stability. To address the challenge, this paper proposes a solver that improves numerical stability by employing…

Systems and Control · Electrical Eng. & Systems 2024-11-20 Aboutaleb Haddadi , Evangelos Farantatos , Ilhan Kocar

The Vlasov-Maxwell system of equations, which describes classical plasma physics, is extremely challenging to solve, even by numerical simulation on powerful computers. By linearizing and assuming a Maxwellian background distribution…

Quantum Physics · Physics 2019-12-19 Alexander Engel , Graeme Smith , Scott E. Parker

Tensor computations present significant performance challenges that impact a wide spectrum of applications ranging from machine learning, healthcare analytics, social network analysis, data mining to quantum chemistry and signal processing.…

Distributed, Parallel, and Cluster Computing · Computer Science 2020-01-06 Jiajia Li , Mahesh Lakshminarasimhan , Xiaolong Wu , Ang Li , Catherine Olschanowsky , Kevin Barker

We report the development of a parallel FORTRAN code, RCCPAC, to solve the relativistic coupled-cluster equations for closed-shell and one-valence atoms and ions. The parallelization is implemented through the use of message passing…

Atomic Physics · Physics 2017-02-08 B. K. Mani , Siddhartha Chattopadhyay , D. Angom

This paper proposes a control algorithm for stable implementation of asynchronous parallel quadratic programming (PQP) through dual decomposition technique. In general, distributed and parallel optimization requires synchronization of data…

Systems and Control · Electrical Eng. & Systems 2019-11-26 Kooktae Lee

A fundamental macroscopic description of a magnetized plasma is the Vlasov equation supplemented by the nonlinear inverse-square force Fokker-Planck collision operator [Rosenbluth et al., Phys. Rev., 107, 1957]. The Vlasov part describes…

Plasma Physics · Physics 2015-09-30 Eero Hirvijoki , Jeff Candy , Emily Belli , Ola Embréus

In this work, we investigate the potential utility of parallelization for meeting real-time constraints and minimizing energy. We consider malleable Gang scheduling of implicit-deadline sporadic tasks upon multiprocessors. We first show the…

Operating Systems · Computer Science 2013-02-08 Nathan Fisher , Joël Goossens , Pradeep M. Hettiarachchi , Antonio Paolillo

We propose a novel approach for navigating in polygonal environments by synthesizing controllers that take as input relative displacement measurements with respect to a set of landmarks. Our algorithm is based on solving a sequence of…

Systems and Control · Electrical Eng. & Systems 2020-10-13 Mahroo Bahreinian , Erfan Aasi , Roberto Tron

We study a stochastic particle system with a logarithmically-singular inter-particle interaction potential which allows for inelastic particle collisions. We relate the squared Bessel process to the evolution of localized clusters of…

Probability · Mathematics 2017-10-04 Gleb Zhelezov , Ibrahim Fatkullin

Variational quantum eigensolvers (VQE) are among the most promising approaches for solving electronic structure problems on near-term quantum computers. A critical challenge for VQE in practice is that one needs to strike a balance between…

We present a computational framework for piecewise constant functions (PCFs) and use this for several types of computations that are useful in statistics, e.g., averages, similarity matrices, and so on. We give a linear-time,…

Computation · Statistics 2024-04-11 Björn H. Wehlin