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Simulating electronic structure on a quantum computer requires encoding of fermionic systems onto qubits. Common encoding methods transform a fermionic system of $N$ spin-orbitals into an $N$-qubit system, but many of the fermionic…

Quantum Physics · Physics 2022-06-07 Yu Shee , Pei-Kai Tsai , Cheng-Lin Hong , Hao-Chung Cheng , Hsi-Sheng Goan

We present a new method for state preparation using the Unitary Vibrational Coupled-Cluster (UVCC) technique. Our approach utilizes redundancies in the Hilbert space in the direct mapping of vibrational modes into qubits. By eliminating…

Quantum Physics · Physics 2024-12-06 Michal Szczepanik , Emil Zak

The analysis of a chemical reaction along the ground state potential energy surface in conjunction with an unknown spin state is challenging because electronic states must be separately computed several times using different spin…

Chemical Physics · Physics 2023-03-14 Soichi Shirai , Hokuto Iwakiri , Keita Kanno , Takahiro Horiba , Keita Omiya , Hirotoshi Hirai , Sho Koh

We introduce the Adaptive Derivative-Assembled Pseudo-Trotter ansatz Variational Majorana Propagation Eigensolver (ADAPT-VMPE), a quantum-inspired classical algorithm that exploits Majorana Propagation (MP) to produce circuits for…

We time-evolve a translationally invariant quantum state on the Quantinuum H1-1 trapped-ion quantum processor, studying the dynamical quantum phase transition of the transverse field Ising model. This physics requires a delicate…

Quantum computing offers a scalable approach to solving the nuclear shell model, a highly complex and exponentially scaled many-body problem. This work presents a numerical simulation of the subspace search variational quantum eigensolver…

Nuclear Theory · Physics 2025-12-16 Bhoomika Maheshwari , Paul Stevenson , P. Van Isacker

Mapping out phase diagrams of quantum systems using classical simulations can be challenging or intractable due to the computational resources required to simulate even small quantum systems far away from the thermodynamic limit. We…

Quantum Physics · Physics 2024-06-05 Jan Lukas Bosse , Raul Santos , Ashley Montanaro

Quantum imaginary-time evolution (QITE) is a promising tool to prepare thermal or ground states of Hamiltonians, as convergence is guaranteed when the evolved state overlaps with the ground state. However, its implementation using a a…

Quantum Physics · Physics 2025-01-20 Ioannis Kolotouros , David Joseph , Anand Kumar Narayanan

Preparing the ground state of a system is an important task in physics. We propose a quantum algorithm for preparing the ground state of a physical system that can be simulated on a quantum computer. The system is coupled to an ancillary…

Quantum Physics · Physics 2018-05-14 Hefeng Wang

Molecular quantum simulations with the variational quantum eigensolver (VQE) rely on ansatz states that approximate the molecular ground states. These ansatz states are generally defined by parametrized fermionic excitation operators and an…

Quantum Physics · Physics 2021-01-04 Yordan S. Yordanov , David R. M. Arvidsson-Shukur , Crispin H. W. Barnes

We propose a hybrid variational framework that enhances Neural Quantum States (NQS) with a Normalising Flow-based sampler to improve the expressivity and trainability of quantum many-body wavefunctions. Our approach decouples the sampling…

Quantum Physics · Physics 2025-06-17 Vishal S. Ngairangbam , Michael Spannowsky , Timur Sypchenko

Variational Quantum Algorithms (VQAs) combine quantum circuits with classical optimization to tackle problems that may benefit from the capabilities of near-term quantum hardware. In knowledge graph embedding, recent proposals based on this…

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

We propose the unitary variational quantum-neural hybrid eigensolver (U-VQNHE), which improves upon the original VQNHE by enforcing unitary neural transformations. The non-unitary nature of VQNHE causes normalization issues and divergence…

Quantum Physics · Physics 2026-03-06 Minwoo Kim , Kyoung Keun Park , Uihwan Jeong , Sangyeon Lee , Taehyun Kim

In this work, we introduce the Quantum Adaptive Excitation Network (QAE-Net), a hybrid quantum-classical framework designed to enhance channel attention mechanisms in Convolutional Neural Networks (CNNs). QAE-Net replaces the classical…

Quantum Physics · Physics 2025-07-16 Yu-Chao Hsu , Kuan-Cheng Chen , Tai-Yue Li , Nan-Yow Chen

We propose a variational quantum eigensolver (VQE) algorithm that uses a fault-tolerant gate-set, and is hence suitable for implementation on a future error-corrected quantum computer. VQE quantum circuits are typically designed for…

Quantum Physics · Physics 2023-03-09 Hasan Sayginel , Francois Jamet , Abhishek Agarwal , Dan E. Browne , Ivan Rungger

In order to answer the problem of Quantum Phase Estimation Algorithm been not suitable for NISQ devices, and allows one to outperform classical computers, Variational Quantum Algorithms (VQAs) were designed. Our subject of interest is the…

Quantum Physics · Physics 2022-10-28 Max Alteg , Baptiste Chevalier , Octave Mestoudjian , Johan-Luca Rossi

Neural-network quantum states (NQS) are powerful neural-network ans\"atzes that have emerged as promising tools for studying quantum many-body physics through the lens of the variational principle. These architectures are known to be…

Disordered Systems and Neural Networks · Physics 2025-07-28 Jake McNaughton , Mohamed Hibat-Allah

We introduce a hybrid quantum-classical variational algorithm to simulate ground-state phase diagrams of frustrated quantum spin models in the thermodynamic limit. The method is based on a cluster-Gutzwiller ansatz where the wave function…

Quantum Physics · Physics 2022-12-14 Daniel Huerga

We propose a novel deterministic method for preparing arbitrary quantum states. When our protocol is compiled into CNOT and arbitrary single-qubit gates, it prepares an $N$-dimensional state in depth $O(\log(N))$ and spacetime allocation (a…