Ground State Energy of He molecule Using a Four-Qubit Photonic Processor with the Variational Quantum Eigensolver
- URL: http://arxiv.org/abs/2504.07568v2
- Date: Sat, 12 Apr 2025 12:23:11 GMT
- Title: Ground State Energy of He molecule Using a Four-Qubit Photonic Processor with the Variational Quantum Eigensolver
- Authors: Badie Ghavami, Forouzan Mirmasoudi,
- Abstract summary: We have explored the quantum processor application to compute the He molecule ground state energy.<n>Results show a significant improvement in accuracy compared to classical computational methods.<n>This work highlights the potential of quantum processors in the fields of quantum chemistry, computational physics, and data science.
- Score: 0.0
- License: http://creativecommons.org/licenses/by/4.0/
- Abstract: To understand the properties and interactions of materials, and determining the ground state energies is one of the important challenges in quantum chemistry, materials science, and quantum mechanics, where quantum computing can play an important role for studying the properties of materials. In this study, we have explored the quantum processor application to compute the He molecule ground state energy which utilizes the Variational Quantum Eigensolver (VQE) algorithm. In here, we have implemented VQE on a state-of-the-art quantum processor, optimizing a parameterized quantum circuit to minimize the energy expectation value of the He molecule's Hamiltonian on the four qubits processor. The obtained results of this work show a significant improvement in accuracy compared to classical computational methods, such as Hartree-Fock and density functional theory, which demonstrate the compute potential of quantum algorithms in quantum many-body problems. Thus, these results demonstrate the advantages of quantum computing in achieving high accuracy in simulations of molecular and material properties, and pave the way for future applications in more complex systems. This work highlights the potential of quantum processors in the fields of quantum chemistry, computational physics, and data science.
Related papers
- Molecular Quantum Transformer [0.0]
We propose the Molecular Quantum Transformer (MQT) for modeling interactions in molecular quantum systems.
By utilizing quantum circuits to implement the attention mechanism on the molecular configurations, MQT can efficiently calculate ground-state energies for all configurations.
Our method offers an alternative to existing quantum algorithms for estimating ground-state energies, opening new avenues in quantum chemistry and materials science.
arXiv Detail & Related papers (2025-03-27T16:54:15Z) - Quantum data learning for quantum simulations in high-energy physics [55.41644538483948]
We explore the applicability of quantum-data learning to practical problems in high-energy physics.
We make use of ansatz based on quantum convolutional neural networks and numerically show that it is capable of recognizing quantum phases of ground states.
The observation of non-trivial learning properties demonstrated in these benchmarks will motivate further exploration of the quantum-data learning architecture in high-energy physics.
arXiv Detail & Related papers (2023-06-29T18:00:01Z) - Use VQE to calculate the ground energy of hydrogen molecules on IBM
Quantum [2.3889084213601346]
We implement the Variational Quantum Eigensolver (VQE) algorithm using Qiskit on the IBM Quantum platform to calculate the ground state energy of a hydrogen molecule.
Our fi ndings demonstrate that VQE can effi ciently calculate molecular properties with high accuracy.
arXiv Detail & Related papers (2023-05-11T02:53:26Z) - Quantum Machine Learning: from physics to software engineering [58.720142291102135]
We show how classical machine learning approach can help improve the facilities of quantum computers.
We discuss how quantum algorithms and quantum computers may be useful for solving classical machine learning tasks.
arXiv Detail & Related papers (2023-01-04T23:37:45Z) - Optimal Stochastic Resource Allocation for Distributed Quantum Computing [50.809738453571015]
We propose a resource allocation scheme for distributed quantum computing (DQC) based on programming to minimize the total deployment cost for quantum resources.
The evaluation demonstrates the effectiveness and ability of the proposed scheme to balance the utilization of quantum computers and on-demand quantum computers.
arXiv Detail & Related papers (2022-09-16T02:37:32Z) - Recompilation-enhanced simulation of electron-phonon dynamics on IBM
Quantum computers [62.997667081978825]
We consider the absolute resource cost for gate-based quantum simulation of small electron-phonon systems.
We perform experiments on IBM quantum hardware for both weak and strong electron-phonon coupling.
Despite significant device noise, through the use of approximate circuit recompilation we obtain electron-phonon dynamics on current quantum computers comparable to exact diagonalisation.
arXiv Detail & Related papers (2022-02-16T19:00:00Z) - Kernel-Function Based Quantum Algorithms for Finite Temperature Quantum
Simulation [5.188498150496968]
We present a quantum kernel function (QKFE) algorithm for solving thermodynamic properties of quantum many-body systems.
As compared to its classical counterpart, namely the kernel method (KPM), QKFE has an exponential advantage in the cost of both time and memory.
We demonstrate its efficiency with applications to one and two-dimensional quantum spin models, and a fermionic lattice.
arXiv Detail & Related papers (2022-02-02T18:00:04Z) - Variational Quantum Computation of Molecular Linear Response Properties
on a Superconducting Quantum Processor [20.69554086981598]
We introduce a pragmatic variational quantum response (VQR) algorithm for response properties, which circumvents the need for deep quantum circuits.
We report the first simulation of linear response properties of molecules including dynamic polarizabilities and absorption spectra on a superconducting quantum processor.
arXiv Detail & Related papers (2022-01-07T12:24:03Z) - On exploring the potential of quantum auto-encoder for learning quantum systems [60.909817434753315]
We devise three effective QAE-based learning protocols to address three classically computational hard learning problems.
Our work sheds new light on developing advanced quantum learning algorithms to accomplish hard quantum physics and quantum information processing tasks.
arXiv Detail & Related papers (2021-06-29T14:01:40Z) - Information Scrambling in Computationally Complex Quantum Circuits [56.22772134614514]
We experimentally investigate the dynamics of quantum scrambling on a 53-qubit quantum processor.
We show that while operator spreading is captured by an efficient classical model, operator entanglement requires exponentially scaled computational resources to simulate.
arXiv Detail & Related papers (2021-01-21T22:18:49Z) - Benchmarking the Variational Quantum Eigensolver through Simulation of
the Ground State Energy of Prebiotic Molecules on High-Performance Computers [0.0]
We use the Variational Quantum Eigensolver (VQE) as implemented in the Qiskit software package to compute the ground state energy of small molecules.
The work aims to benchmark algorithms for calculating the electronic structure and energy surfaces of molecules of relevance to prebiotic chemistry.
arXiv Detail & Related papers (2020-10-26T13:29:41Z) - An Application of Quantum Annealing Computing to Seismic Inversion [55.41644538483948]
We apply a quantum algorithm to a D-Wave quantum annealer to solve a small scale seismic inversions problem.
The accuracy achieved by the quantum computer is at least as good as that of the classical computer.
arXiv Detail & Related papers (2020-05-06T14:18:44Z) - Considerations for evaluating thermodynamic properties with hybrid
quantum-classical computing work-flows [0.0]
Quantum chemistry applications on quantum computers currently rely heavily on the variational quantum eigensolver algorithm.
We present a summary of the hybrid quantum-classical work-flow to compute thermodynamic properties.
We show that through careful selection of work-flow options, nearly order-of-magnitude increases in accuracy are possible at equivalent computing time.
arXiv Detail & Related papers (2020-03-04T19:32:53Z) - Simulating quantum chemistry in the seniority-zero space on qubit-based
quantum computers [0.0]
We combine the so-called seniority-zero, or paired-electron, approximation of computational quantum chemistry with techniques for simulating molecular chemistry on gate-based quantum computers.
We show that using the freed-up quantum resources for increasing the basis set can lead to more accurate results and reductions in the necessary number of quantum computing runs.
arXiv Detail & Related papers (2020-01-31T19:44:37Z)
This list is automatically generated from the titles and abstracts of the papers in this site.
This site does not guarantee the quality of this site (including all information) and is not responsible for any consequences.