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We introduce a constructive method for mapping non-unitary dynamics to a weighted set of unitary operations. We utilize this construction to derive a new correspondence between real and imaginary time, which we term Imaginary Time Quantum…

Quantum Physics · Physics 2024-09-11 Jacob M. Leamer , Alicia B. Magann , Denys I. Bondar , Gerard McCaul

The matrix product state (MPS) ansatz offers a promising approach for finding the ground state of molecular Hamiltonians and solving quantum chemistry problems. Building on this concept, the proposed technique of quantum circuit MPS (QCMPS)…

Quantum Physics · Physics 2024-10-02 Hao-En Li , Xiang Li , Jia-Cheng Huang , Guang-Ze Zhang , Zhu-Ping Shen , Chen Zhao , Jun Li , Han-Shi Hu

Quantum imaginary time evolution (QITE) algorithm is one of the most promising variational quantum algorithms (VQAs), bridging the current era of Noisy Intermediate-Scale Quantum devices and the future of fully fault-tolerant quantum…

Quantum Physics · Physics 2025-10-28 Min Chen , Bingzhi Zhang , Quntao Zhuang , Junyu Liu

Developing scalable quantum algorithms to study finite-temperature physics of quantum many-body systems has attracted considerable interest due to recent advancements in quantum hardware. However, such algorithms in their present form…

The time evolution operator plays a crucial role in the precise computation of chemical experiments on quantum computers and holds immense promise for advancing the fields of physical and computer sciences, with applications spanning…

Efficiently preparing approximate ground-states of large, strongly correlated systems on quantum hardware is challenging and yet nature is innately adept at this. This has motivated the study of thermodynamically inspired approaches to…

We propose a hybrid quantum-classical algorithm for solving QUBO problems using an Imaginary Time Evolution-Mimicking Circuit (ITEMC). The circuit parameters are optimized to closely mimic imaginary time evolution, using only single- and…

Quantum Physics · Physics 2025-06-19 Yahui Chai , Alice Di Tucci

Dynamic quantum circuits combine mid-circuit measurement with classical feed-forward, enabling circuit constructions with reduced entangling-gate depth. Here, we investigate their use in Quantum Imaginary Time Evolution (QITE), where…

Quantum Physics · Physics 2026-03-06 Albert Lund , Erika Magnusson , Werner Dobrautz , Laura García-Álvarez

We calculate the energy levels and corresponding eigenstates of an interacting scalar quantum field theory on a lattice using a continuous-variable version of the quantum imaginary time evolution algorithm. Only a single qumode is needed…

Quantum Physics · Physics 2022-01-19 Kübra Yeter-Aydeniz , Eleftherios Moschandreou , George Siopsis

Imaginary-time evolution, an important technique in tensor network and quantum Monte Carlo algorithms on classical computers, has recently been adapted to quantum computing. In this study, we focus on probabilistic imaginary-time evolution…

Strongly Correlated Electrons · Physics 2025-11-27 Satoshi Ejima , Kazuhiro Seki , Benedikt Fauseweh , Seiji Yunoki

Coupled non-linear Schr\"{o}dinger equations are crucial in describing dynamics of many particle systems. We present a quantum imaginary time evolution (ITE) algorithm as a solution to such equations in the case of nuclear Hartree-Fock…

Nuclear Theory · Physics 2024-12-02 Yang Hong Li , Jim Al-Khalili , Paul Stevenson

We propose a nonvariational scheme for geometry optimization of molecules for the first-quantized eigensolver, a recently proposed framework for quantum chemistry using the probabilistic imaginary-time evolution (PITE) on a quantum…

Quantum Physics · Physics 2023-11-06 Taichi Kosugi , Hirofumi Nishi , Yuichiro Matsushita

We introduce the framework of model space into quantum imaginary time evolution (QITE) to enable stable estimation of ground and excited states using a quantum computer. Model-space QITE (MSQITE) propagates a model space to the exact one by…

Quantum Physics · Physics 2023-10-02 Takashi Tsuchimochi , Yoohee Ryo , Siu Chung Tsang , Seiichiro L. Ten-no

Variational Quantum Imaginary Time Evolution (VQITE) is a leading technique for ground state preparation on quantum computers. A significant computational challenge of VQITE is the determination of the quantum geometric tensor. We show that…

Quantum Physics · Physics 2024-09-19 Aeishah Ameera Anuar , Francois Jamet , Fabio Gironella , Fedor Simkovic , Riccardo Rossi

In this work, we investigate the capability of known quantum-computing algorithms for fault-tolerant quantum computing to simulate the laser-driven electron dynamics in small molecules such as lithium hydride. These computations are…

Quantum Physics · Physics 2022-05-24 Fabian Langkabel , Annika Bande

Imaginary-time evolution plays an important role in algorithms for computing ground-state and thermal equilibrium properties of quantum systems, but can be challenging to simulate on classical computers. Many quantum algorithms for…

Quantum Physics · Physics 2025-07-22 Annie Ray , Esha Swaroop , Ningping Cao , Michael Vasmer , Anirban Chowdhury

In this study, we employed a quantum computer to solve a low-energy effective Hamiltonian for spin defects in diamond (so-called NV centre) and wurtzite-type aluminium nitride, which are anticipated to be qubits. The probabilistic…

The real- and imaginary-time evolution of quantum states are powerful tools in physics, chemistry, and beyond, to investigate quantum dynamics, prepare ground states or calculate thermodynamic observables. On near-term devices, variational…

Quantum Physics · Physics 2024-02-27 Julien Gacon , Jannes Nys , Riccardo Rossi , Stefan Woerner , Giuseppe Carleo

Quantum computers have the potential to simulate chemical systems beyond the capability of classical computers. Recent developments in hybrid quantum-classical approaches enable the determinations of the ground or low energy states of…

Quantum Physics · Physics 2021-12-06 Chee-Kong Lee , Jonathan Wei Zhong Lau , Liang Shi , Leong Chuan Kwek

Quantum simulation on emerging quantum hardware is a topic of intense interest. While many studies focus on computing ground state properties or simulating unitary dynamics of closed systems, open quantum systems are an interesting target…

Quantum Physics · Physics 2022-03-21 Hirsh Kamakari , Shi-Ning Sun , Mario Motta , Austin J. Minnich