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We introduce two variations of the quantum phase estimation algorithm: quantum shifted phase estimation and quantum punctured phase estimation. The shifted method employs a bit-string left shift to discard the most significant bit and focus…

Quantum Physics · Physics 2025-12-11 Yonghae Lee , Minjin Choi , Youngho Min , Eunok Bae , Sunghyun Bae

We demonstrate a method that merges the quantum filter diagonalization (QFD) approach for hybrid quantum/classical solution of the time-independent electronic Schr\"odinger equation with a low-rank double factorization (DF) approach for the…

Quantum Physics · Physics 2022-03-21 Jeffrey Cohn , Mario Motta , Robert M. Parrish

As the advances in quantum hardware bring us into the noisy intermediate-scale quantum (NISQ) era, one possible task we can perform without quantum error correction using NISQ machines is the variational quantum eigensolver (VQE) due to its…

Quantum Physics · Physics 2020-07-29 Zhenyu Cai

Effective feature selection is essential for enhancing the performance of artificial intelligence models. It involves identifying feature combinations that optimize a given metric, but this is a challenging task due to the problem's…

Quantum Physics · Physics 2023-03-14 Anton S. Albino , Otto M. Pires , Mauro Q. Nooblath , Erick G. S. Nascimento

Quantum policy evaluation (QPE) is a reinforcement learning (RL) algorithm which is quadratically more efficient than an analogous classical Monte Carlo estimation. It makes use of a direct quantum mechanical realization of a finite Markov…

Due to the wide range of technical applications of actinide elements, a thorough understanding of their electronic structure could complement technological improvements in many different areas. Quantum computing could greatly aid in this…

A construction of covariant quantum phase observables, for Hamiltonians with a finite number of energy eigenvalues, has been recently given by D. Arsenovic et al. [Phys. Rev. A 85, 044103 (2012)]. For Hamiltonians generating periodic…

Quantum Physics · Physics 2012-11-15 Michael J. W. Hall , David T. Pegg

We consider a wide class of semi linear Hamiltonian partial differential equa- tions and their approximation by time splitting methods. We assume that the nonlinearity is polynomial, and that the numerical tra jectory remains at least uni-…

Numerical Analysis · Mathematics 2009-12-16 Erwan Faou , Benoit Grebert

Quantum systems governed by time-dependent Hamiltonians pose significant challenges for the accurate computation of unitary time-evolution operators, which are essential for predicting quantum state dynamics. In this work, we introduce a…

Quantum Physics · Physics 2026-01-21 Antonio Guerra , Daniel Uzcategui-Contreras , Aldo Delgado , Esteban S. Gómez

Despite rapid progress in the development of quantum algorithms in quantum computing as well as numerical simulation methods in classical computing for atomic and molecular applications, no systematic and comprehensive electronic structure…

Quantum computers promise to efficiently solve important problems that are intractable on a conventional computer. For quantum systems, where the dimension of the problem space grows exponentially, finding the eigenvalues of certain…

Unitary evolution under a time dependent Hamiltonian is a key component of simulation on quantum hardware. Synthesizing the corresponding quantum circuit is typically done by breaking the evolution into small time steps, also known as…

Quantum computing is being extensively used in quantum chemistry, especially in simulating simple molecules and evaluating properties like the ground state energy, dipole moment, etc. The transformation of a molecular Hamiltonian from the…

Quantum Physics · Physics 2024-01-18 Harshdeep Singh , Sabyashachi Mishra , Sonjoy Majumder

Under suitable assumptions, the algorithms in [Lin, Tong, Quantum 2020] can estimate the ground state energy and prepare the ground state of a quantum Hamiltonian with near-optimal query complexities. However, this is based on a block…

Quantum Physics · Physics 2022-10-19 Yulong Dong , Lin Lin , Yu Tong

Many researchers have been heavily investigated on quantum phase estimation (QPE) algorithms to find the unknown phase, since QPE is the core building block of the most quantum algorithms such as the Shor's factoring algorithm, quantum…

Quantum Physics · Physics 2019-03-19 Hamed Mohammadbagherpoor , Young-Hyun Oh , Anand Singh , Xianqing Yu , Andy J. Rindos

The contextual subspace variational quantum eigensolver (CS-VQE) is a hybrid quantum-classical algorithm that approximates the ground-state energy of a given qubit Hamiltonian. It achieves this by separating the Hamiltonian into contextual…

Quantum Physics · Physics 2023-02-14 Alexis Ralli , Tim Weaving , Andrew Tranter , William M. Kirby , Peter J. Love , Peter V. Coveney

We introduce HAML (Hamiltonian Adaptation via Meta-Learning), a framework for fast online adaptation of effective Hamiltonian models of superconducting quantum processors. HAML proceeds in two phases. A supervised training phase uses an…

Quantum Physics · Physics 2026-04-29 Arielle Sanford , Andrew T. Kamen , Frederic T. Chong , Andy J. Goldschmidt

Quantum computers are expected to perform the full-configuration interaction calculations with less computational resources compared to classical ones, thanks to the use of the quantum phase estimation (QPE) algorithms. However, only a…

Quantum Physics · Physics 2024-12-05 Yusuke Ino , Misaki Yonekawa , Hideto Yuzawa , Yuichiro Minato , Kenji Sugisaki

Quantum error mitigation (QEM) protocols have provably exponential bounds on the cost scaling; however, exploring which regimes QEM can recover usable results is still of sizable interest. The expected absence of complete error correction…

Quantum Physics · Physics 2025-05-12 Ugnė Liaubaitė , S. E. Skelton

In designing quantum control, it is generally required to simulate the controlled system evolution with a classical computer. However, computing the time evolution operator can be quite resource-consuming since the total Hamiltonian is…

Quantum Physics · Physics 2022-10-25 Xiaodong Yang , Xinfang Nie , Yunlan Ji , Tao Xin , Dawei Lu , Jun Li