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We propose an efficient protocol for digital quantum simulation of quantum chemistry problems and enhanced digital-analog quantum simulation of transport phenomena in biomolecules with superconducting circuits. Along these lines, we…

Quantum Physics · Physics 2016-06-23 L. García-Álvarez , U. Las Heras , A. Mezzacapo , M. Sanz , E. Solano , L. Lamata

We develop a fourth-order Magnus expansion based quantum algorithm for the simulation of many-body problems involving two-level quantum systems with time-dependent Hamiltonians, $\mathcal{H}(t)$. A major hurdle in the utilization of the…

Quantum Physics · Physics 2023-12-14 Guannan Chen , Mohammadali Foroozandeh , Chris Budd , Pranav Singh

This work aims to address the bottleneck issues of hardware resource limitation and decoherence error in the Hamiltonian simulation of quantum fluids, which are caused by the standard quantum Fourier transform and the evolution of momentum…

Quantum Physics · Physics 2026-04-21 Zhiyuan Zhang , Bolin Zhang , Yongguang Lv , Ruiqing He , Hengliang Guo , Jiandong Shang , Qiang Chen

We investigate the performance and accuracy of digital quantum algorithms for the study of static and dynamic properties of the fermionic Hubbard model at half-filling with next-nearest neighbour hopping terms. We provide quantum circuits…

We provide practical simulation methods for scalar field theories on a quantum computer that yield improved asymptotics as well as concrete gate estimates for the simulation and physical qubit estimates using the surface code. We achieve…

The study of real time dynamics of nuclear systems is of great importance to provide theoretical predictions of cross sections relevant for both terrestrial experiments as well as applications in astrophysics. First principles simulations…

Quantum Physics · Physics 2025-11-10 Luca Spagnoli , Chiara Lissoni , Alessandro Roggero

Recent numerical advances in the field of strongly correlated electron systems allow the calculation of the entanglement spectrum and entropies for interacting fermionic systems. An explicit determination of the entanglement (modular)…

Strongly Correlated Electrons · Physics 2018-11-16 Francesco Parisen Toldin , Fakher F. Assaad

Hamiltonian simulation, i.e., simulating the real time evolution of a target quantum system, is a natural application of quantum computing. Trotter-Suzuki splitting methods can generate corresponding quantum circuits; however, a faithful…

Quantum Physics · Physics 2024-03-21 Ayse Kotil , Rahul Banerjee , Qunsheng Huang , Christian B. Mendl

In this work we investigate methods to improve the efficiency and scalability of quantum algorithms for quantum chemistry applications. We propose a transformation of the electronic structure Hamiltonian in the second quantization framework…

Learning Hamiltonian of a quantum system is indispensable for prediction of the system dynamics and realization of high fidelity quantum gates. However, it is a significant challenge to efficiently characterize the Hamiltonian when its…

Quantum Physics · Physics 2020-01-08 P. -Y. Hou , L. He , F. Wang , X. -Z. Huang , W. -G. Zhang , X. -L. Ouyang , X. Wang , W. -Q. Lian , X. -Y. Chang , L. -M. Duan

We study a hardware-efficient variational quantum algorithm ansatz tailored for the trapped-ion quantum simulator, HEA-TI. We leverage programmable single-qubit rotations and global spin-spin interactions among all ions, reducing the…

Quantum Physics · Physics 2024-07-04 J. -Z. Zhuang , Y. -K. Wu , L. -M. Duan

We present a quantum algorithm for simulating rovibrational Hamiltonians on fault-tolerant quantum computers. The method integrates exact curvilinear kinetic energy operators and general-form potential energy surfaces expressed in a hybrid…

Quantum Physics · Physics 2026-04-07 Michał Szczepanik , Ákos Nagy , Emil Żak

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

We present a classical algorithm for simulating universal quantum circuits composed of "free" nearest-neighbour matchgates or equivalently fermionic-linear-optical (FLO) gates, and "resourceful" non-Gaussian gates. We achieve the promotion…

Quantum Physics · Physics 2024-12-11 Oliver Reardon-Smith , Michał Oszmaniec , Kamil Korzekwa

Shuttling of single electrons in gate-defined silicon quantum dots is numerically simulated. A minimal gate geometry without explicit tunnel barrier gates is introduced, and used to define a chain of accumulation mode quantum dots, each…

Quantum Physics · Physics 2021-01-01 Brandon Buonacorsi , Benjamin Shaw , Jonathan Baugh

Quantum simulations of many-body systems are among the most promising applications of quantum computers. In particular, models based on strongly-correlated fermions are central to our understanding of quantum chemistry and materials…

A universal family of Hamiltonians can be used to simulate any local Hamiltonian by encoding its full spectrum as the low-energy subspace of a Hamiltonian from the family. Many spin-lattice model Hamiltonians -- such as Heisenberg or XY…

Quantum Physics · Physics 2021-02-08 Leo Zhou , Dorit Aharonov

In recent years, low-dimensional materials with tetragonal $P4/nmm$ (orthorhombic $Pnma$) space group having square-net (chain-like) substructure of $p$-block elements have been studied extensively. By using a first-principles calculation…

Materials Science · Physics 2018-10-18 S. I. Hyun , Inho Lee , Geunsik Lee , J. H. Shim

The simulation of chemistry is among the most promising applications of quantum computing. However, most prior work exploring algorithms for block-encoding, time-evolving, and sampling in the eigenbasis of electronic structure Hamiltonians…

We use an n-spin system with permutation symmetric zz-interaction for simulating arbitrary pair-interaction Hamiltonians. The calculation of the required time overhead is mathematically equivalent to a separability problem of n-qubit…

Quantum Physics · Physics 2007-05-23 P. Wocjan , D. Janzing , Th. Beth