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Recent work has deployed linear combinations of unitaries techniques to reduce the cost of fault-tolerant quantum simulations of correlated electron models. Here, we show that one can sometimes improve upon those results with optimized…

The Quantum Fourier transform (QFT) is a key ingredient in most quantum algorithms. We have compared various spin-based quantum computing schemes to implement the QFT from the point of view of their actual time-costs and the accuracy of the…

Quantum Physics · Physics 2014-08-07 Kavita Dorai , Dieter Suter

Recently double-bracket quantum algorithms have been proposed as a way to compile circuits for approximating eigenstates. Physically, they consist of appropriately composing evolutions under an input Hamiltonian together with diagonal…

We introduce the problem of unitarization. Unitarization is the problem of taking $k$ input quantum circuits that produce orthogonal states from the all $0$ state, and create an output circuit implementing a unitary with its first $k$…

Quantum Physics · Physics 2021-09-15 Joshua Cook

By expressing the electronic wavefunction in an explicitly-correlated (Jastrow-factorised) form, a similarity-transformed effective Hamiltonian can be derived. The effective Hamiltonian is non-Hermitian and contains three-body interactions.…

Chemical Physics · Physics 2019-08-09 Aron J. Cohen , Hongjun Luo , Kai Guther , Werner Dobrautz , David P. Tew , Ali Alavi

A formal analysis is conducted on the exactness of various forms of unitary coupled cluster (UCC) theory based on particle-hole excitation and de-excitation operators. Both the conventional single exponential UCC parameterization and a…

Chemical Physics · Physics 2020-01-29 Francesco A. Evangelista , Garnet Kin-Lic Chan , Gustavo E. Scuseria

Many applications of practical interest rely on time evolution of Hamiltonians that are given by a sum of Pauli operators. Quantum circuits for exact time evolution of single Pauli operators are well known, and can be extended trivially to…

Quantum Physics · Physics 2020-09-16 Ewout van den Berg , Kristan Temme

Achieving an accurate description of fermionic systems typically requires considerably many more orbitals than fermions. Previous resource analyses of quantum chemistry simulation often failed to exploit this low fermionic number…

Quantum Physics · Physics 2022-05-24 Sam McArdle , Earl Campbell , Yuan Su

We demonstrate how structured decompositions of unitary operators can be employed to derive control schemes for finite-level quantum systems that require only sequences of simple control pulses such as square wave pulses with finite rise…

Quantum Physics · Physics 2009-11-07 S. G. Schirmer , A. D. Greentree , V. Ramakrishna , H. Rabitz

Quantum operations on pure states can be fully represented by unitary matrices. Variational quantum circuits, also known as quantum neural networks, embed data and trainable parameters into gate-based operations and optimize the parameters…

Quantum Physics · Physics 2026-04-09 Basil Kyriacou , Mo Kordzanganeh , Maniraman Periyasamy , Alexey Melnikov

The Variational Quantum Eigensolver approach to the electronic structure problem on a quantum computer involves measurement of the Hamiltonian expectation value. Formally, quantum mechanics allows one to measure all mutually commuting or…

Quantum Physics · Physics 2020-03-17 Tzu-Ching Yen , Vladyslav Verteletskyi , Artur F. Izmaylov

In the fermion loop formulation the contributions to the partition function naturally separate into topological equivalence classes with a definite sign. This separation forms the basis for an efficient fermion simulation algorithm using a…

High Energy Physics - Lattice · Physics 2015-09-14 David Baumgartner , Urs Wenger

Developing optimal strategies to calibrate quantum processors for high-fidelity operation is one of the outstanding challenges in quantum computing today. Here, we demonstrate multiple examples of high-fidelity operations achieved using a…

Estimating the expectation value of an operator corresponding to an observable is a fundamental task in quantum computation. It is often impossible to obtain such estimates directly, as the computer is restricted to measuring in a fixed…

We propose a method for the realization of the two-qubit quantum Fourier transform (QFT) using a Hamiltonian which possesses the circulant symmetry. Importantly, the eigenvectors of the circulant matrices are the Fourier modes and do not…

Quantum Physics · Physics 2020-01-28 Peter A. Ivanov , Nikolay V. Vitanov

Shor's algorithm for the prime factorization of numbers provides an exponential speedup over the best known classical algorithms. However, nontrivial practical applications have remained out of reach due to experimental limitations. The…

Quantum Physics · Physics 2025-03-21 Abu Musa Patoary , Amit Vikram , Victor Galitski

Transformations which convert between Fermionic modes and qubit operations have become a ubiquitous tool in quantum algorithms for simulating systems. Similarly, collections of Pauli operators might be obtained from solutions of non-local…

Quantum Physics · Physics 2023-06-28 Lane G. Gunderman

Performing large-scale, accurate quantum simulations of many-fermion systems is a central challenge in quantum science, with applications in chemistry, materials, and high-energy physics. Despite significant progress, realizing generic…

Quantum Physics · Physics 2025-09-12 Nishad Maskara , Marcin Kalinowski , Daniel Gonzalez-Cuadra , Mikhail D. Lukin

We introduce a novel parameterization of complex unitary matrices, which allows for the efficient photonic implementation of arbitrary linear discrete unitary operators. The proposed architecture is built on factorizing an $N \times N$…

Optics · Physics 2023-07-17 Matthew Markowitz , Mohammad-Ali Miri

We establish a toolbox for studying and applying spin-adapted generalized Pauli constraints (GPCs) in few-electron quantum systems. By exploiting the spin symmetry of realistic $N$-electron wave functions, the underlying one-body pure…