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The Random Phase Approximation (RPA) for correlation energy in the grid-based projector augmented wave (gpaw) code is accelerated by porting to the Graphics Processing Unit (GPU) architecture. The acceleration is achieved by grouping…

Computational Physics · Physics 2013-07-31 Jun Yan , Lin Li , Christopher O'Grady

This work studies the porting and optimization of the tensor network simulator QTensor on GPUs, with the ultimate goal of simulating quantum circuits efficiently at scale on large GPU supercomputers. We implement NumPy, PyTorch, and CuPy…

Quantum Physics · Physics 2022-04-14 Danylo Lykov , Angela Chen , Huaxuan Chen , Kristopher Keipert , Zheng Zhang , Tom Gibbs , Yuri Alexeev

Efficient simulation of quantum computers is essential for the development and validation of near-term quantum devices and the research on quantum algorithms. Up to date, two main approaches to simulation were in use, based on either full…

Computational Complexity · Computer Science 2020-05-06 Roman Schutski , Danil Lykov , Ivan Oseledets

Simulating quantum circuits (QC) on high-performance computing (HPC) systems has become an essential method to benchmark algorithms and probe the potential of large-scale quantum computation despite the limitations of current quantum…

Langevin Dynamics, Monte Carlo, and all-atom Molecular Dynamics simulations in implicit solvent, widely used to access the microscopic transitions in biomolecules, require a reliable source of random numbers. Here we present the two main…

Chemical Physics · Physics 2010-03-05 A. Zhmurov , K. Rybnikov , Y. Kholodov , V. Barsegov

We present a scheme for the parallelization of quantum Monte Carlo on graphical processing units, focusing on bosonic systems and variational Monte Carlo. We use asynchronous execution schemes with shared memory persistence, and obtain an…

Computational Physics · Physics 2014-12-10 Y. Lutsyshyn

In many real-world applications we are interested in approximating costly functions that are analytically unknown, e.g. complex computer codes. An emulator provides a fast approximation of such functions relying on a limited number of…

Methodology · Statistics 2020-10-02 Hossein Mohammadi , Peter Challenor , Marc Goodfellow , Daniel Williamson

The fundamental question of how to best simulate quantum systems using conventional computational resources lies at the forefront of condensed matter and quantum computation. It impacts both our understanding of quantum materials and our…

Strongly Correlated Electrons · Physics 2021-09-29 Juan Carrasquilla , Di Luo , Felipe Pérez , Ashley Milsted , Bryan K. Clark , Maksims Volkovs , Leandro Aolita

We introduce a particle-based simulation method for granular material in interactive frame rates. We divide the simulation into two decoupled steps. In the first step, a relatively small number of particles is accurately simulated with a…

Graphics · Computer Science 2023-08-04 Alexander Sommer , Ulrich Schwanecke , Elmar Schömer

Quantum Key Distribution is the process of using quantum communication to establish a shared key between two parties. It has been demonstrated the unconditional security and effective communication of quantum communication system can be…

Signal Processing · Electrical Eng. & Systems 2019-02-04 Yue Hu , Yan Wu , Yi Chen , G. C. Wan , S. T. Mei

A procedure for loading particle velocities from a relativistic kappa distribution in particle-in-cell (PIC) and Monte Carlo simulations is presented. It is based on the rejection method and the beta prime distribution. The rejection part…

Plasma Physics · Physics 2022-11-18 Seiji Zenitani , Shin'ya Nakano

Quantum computers can efficiently sample from probability distributions that are believed to be classically intractable, providing a foundation for quantum generative modeling. However, practical training of such models remains challenging,…

Quantum Physics · Physics 2025-11-18 Maria Demidik , Cenk Tüysüz , Michele Grossi , Karl Jansen

The random walk formalism is used across a wide range of applications, from modelling share prices to predicting population genetics. Likewise quantum walks have shown much potential as a frame- work for developing new quantum algorithms.…

Quantum Generative Modelling (QGM) relies on preparing quantum states and generating samples from these states as hidden - or known - probability distributions. As distributions from some classes of quantum states (circuits) are inherently…

Quantum Physics · Physics 2023-10-09 Sachin Kasture , Oleksandr Kyriienko , Vincent E. Elfving

We present a random number generation scheme based on measuring the phase fluctuations of a laser with a simple and compact experimental setup. A simple model is established to analyze the randomness and the simulation result based on this…

Quantum Physics · Physics 2017-09-05 Jie Yang , Jinlu Liu , Qi Su , Zhengyu Li , Fan Fan , Bingjie Xu , Hong Guo

The quadratic assignment problem (QAP) is one of the most difficult combinatorial optimization problems. An effective heuristic for obtaining approximate solutions to the QAP is simulated annealing (SA). Here we describe an SA…

Distributed, Parallel, and Cluster Computing · Computer Science 2015-03-20 Gerald Paul

Quantum circuit simulators have a long tradition of exploiting massive hardware parallelism. Most of the times, parallelism has been supported by special purpose libraries tailored specifically for the quantum circuits. Quantum circuit…

Quantum Physics · Physics 2021-06-29 Oumarou Oumarou , Alexandru Paler , Robert Basmadjian

Quantum phase estimation is at the heart of most quantum algorithms with exponential speedup. In this letter we demonstrate how to utilize it to compute the dynamical response functions of many-body quantum systems. Specifically, we design…

Quantum Physics · Physics 2021-05-21 Dries Sels , Eugene Demler

Quantum circuits generating probability distributions has applications in several areas. Areas like finance require quantum circuits that can generate distributions that mimic some given data pattern. Hamiltonian simulations require…

Quantum Physics · Physics 2022-08-30 Kalyan Dasgupta , Binoy Paine

A method for generating random $U(1)$ variables with Boltzmann distribution is presented. It is based on the rejection method with transformation of variables. High efficiency is achieved for all range of temparatures or coupling…

High Energy Physics - Lattice · Physics 2009-10-22 Tetsuya Hattori , Hideo Nakajima