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Over the last century, a large number of physical and mathematical developments paired with rapidly advancing technology have allowed the field of quantum chemistry to advance dramatically. However, the lack of computationally efficient…

Quantum Physics · Physics 2011-03-08 James D. Whitfield , Jacob Biamonte , Alán Aspuru-Guzik

A full understanding of open quantum systems requires the characterization of both system and environmental properties. However, the complexity of the environmental statistics in the presence of strong system-bath hybridization and long…

Quantum Physics · Physics 2024-12-06 Pengfei Liang , Neill Lambert , Si Luo , Lingzhen Guo , Mauro Cirio

Approximating the ground state of many-body systems is a key computational bottleneck underlying important applications in physics and chemistry. The most widely known quantum algorithm for ground state approximation, quantum phase…

We introduce an architecture for neural quantum states for many-body quantum-mechanical systems, based on normalizing flows. The use of normalizing flows enables efficient uncorrelated sampling of configurations from the probability…

Quantum Physics · Physics 2024-06-05 Scott Lawrence , Arlee Shelby , Yukari Yamauchi

The simple genetic algorithm is proposed for the simulation of quantum many body dynamics. It uses the selection of entangled quantum states and has the inbuilt absolute decoherence that comes from the limitation of classical memory. It…

Quantum Physics · Physics 2008-01-24 Yuri Ozhigov

Classical computation of electronic properties in large-scale materials remains challenging. Quantum computation has the potential to offer advantages in memory footprint and computational scaling. However, general and practical quantum…

Computational Physics · Physics 2025-10-14 Yiran Bai , Feng Xiong , Xueheng Kuang

A common requirement of quantum simulations and algorithms is the preparation of complex states through sequences of 2-qubit gates. For a generic quantum state, the number of gates grows exponentially with the number of qubits, becoming…

Quantum Physics · Physics 2024-07-08 Matan Ben Dov , David Shnaiderov , Adi Makmal , Emanuele G. Dalla Torre

This work studies the variational quantum eigensolver algorithm, designed to determine the ground state of a quantum mechanical system by combining classical and quantum hardware. Methods of reducing the number of required qubit…

Quantum Physics · Physics 2022-03-01 R. J. P. T. de Keijzer , V. E. Colussi , B. Škorić , S. J. J. M. F. Kokkelmans

Estimating physical properties of quantum states from measurements is one of the most fundamental tasks in quantum science. In this work, we identify conditions on states under which it is possible to infer the expectation values of all…

Quantum Physics · Physics 2024-05-01 Cambyse Rouzé , Daniel Stilck França

Finding ground states of quantum many-body systems is known to be hard for both classical and quantum computers. As a result, when Nature cools a quantum system in a low-temperature thermal bath, the ground state cannot always be found…

Quantum Physics · Physics 2023-09-29 Chi-Fang Chen , Hsin-Yuan Huang , John Preskill , Leo Zhou

In recent years, researchers have been exploring the applications of noisy intermediate-scale quantum (NISQ) computation in various fields. One important area in which quantum computation can outperform classical computers is the ground…

Quantum Physics · Physics 2024-01-30 Ruyu Yang , Tianren Wang , Bing-Nan Lu , Ying Li , Xiaosi Xu

This thesis investigates quantum algorithms for eigenstate preparation, with a focus on solving eigenvalue problems such as the Schrodinger equation by utilizing near-term quantum computing devices. These problems are ubiquitous in several…

Quantum Physics · Physics 2024-12-20 Joey Bonitati

It has been shown that, starting from the state |0>, in the general case, an arbitrary quantum state |\psi> cannot be prepared with exponential precision in polynomial time. However, we show that for the important special case when |\psi>…

Quantum Physics · Physics 2007-05-23 Peter Jaksch

Quantum-classical hybrid algorithms are emerging as promising candidates for near-term practical applications of quantum information processors in a wide variety of fields ranging from chemistry to physics and materials science. We report…

In this paper we develop a quantum algorithm to realize finite temperature simulation on a quantum computer. As quantum computers use real-time evolution we did not use the imaginary time methods popular on classical algorithms. Instead, we…

Quantum Physics · Physics 2019-11-11 Raffaele Miceli , Michael McGuigan

We consider discrete quantum systems coupled to finite environments which may possibly consist of only one particle in contrast to the standard baths which usually consist of continua of oscillators, spins, etc. We find that such finite…

Quantum Physics · Physics 2009-11-13 Jochen Gemmer , Mathias Michel

We describe a quantum algorithm to prepare an arbitrary pure state of a register of a quantum computer with fidelity arbitrarily close to 1. Our algorithm is based on Grover's quantum search algorithm. For sequences of states with suitably…

Quantum Physics · Physics 2007-05-23 Andrei N. Soklakov , Ruediger Schack

Quantum phase transitions materialize as level crossings in the ground-state energy when the parameters of the Hamiltonian are varied. The resulting ground-state phase diagrams are straightforward to determine by exact diagonalization on…

Quantum Physics · Physics 2021-12-10 Akhil Francis , Ephrata Zelleke , Ziyue Zhang , Alexander F. Kemper , J. K. Freericks

We present a quantum-classical hybrid random power method that approximates a ground state of a Hamiltonian. The quantum part of our method computes a fixed number of elements of a Hamiltonian-matrix polynomial via quantum polynomial…

Quantum Physics · Physics 2025-04-17 Taehee Ko , Hyowon Park , Sangkook Choi

Quantum statistical mechanics allows us to extract thermodynamic information from a microscopic description of a many-body system. A key step is the calculation of the density of states, from which the partition function and all…

Quantum Physics · Physics 2025-07-24 Alessandro Summer , Cecilia Chiaracane , Mark T. Mitchison , John Goold