论文标题

Tangelo:用于端机化学工作流程量子计算机的开源Python包装

Tangelo: An Open-source Python Package for End-to-end Chemistry Workflows on Quantum Computers

论文作者

Senicourt, Valentin, Brown, James, Fleury, Alexandre, Day, Ryan, Lloyd, Erika, Coons, Marc P., Bieniasz, Krzysztof, Huntington, Lee, Garza, Alejandro J., Matsuura, Shunji, Plesch, Rudi, Yamazaki, Takeshi, Zaribafiyan, Arman

论文摘要

Tangelo [链接:https://github.com/goodchemistryco/tangelo]是一个开放源Python软件包,用于开发在Apache 2.0许可下发布的量子计算机上的端到端化学工作流程。它旨在支持量子硬件成功实验的设计,并促进量子算法开发的进步。该软件可以通过组装可重复使用的构建块和算法来快速探索不同的方法,并具有灵活性,可以让用户介绍自己的构建块和算法。 Tangelo是后端 - 静脉局,并启用在各种后端(架子,Qiskit,Qulacs,Qulacs,azure Quantum,QDK,CIRQ ...)之间切换,代码的更改最小。该软件包可用于探索量子计算应用程序,例如开放式壳系统,激发态或更相关的与工业相关的系统,通过在大规模上利用问题分解。本文概述了Tangelo的设计选择,哲学和主要特征。

Tangelo [link: https://github.com/goodchemistryco/Tangelo] is an open-source Python software package for the development of end-to-end chemistry workflows on quantum computers, released under Apache 2.0 license. It aims to support the design of successful experiments on quantum hardware, and to facilitate advances in quantum algorithm development. The software enables quick exploration of different approaches by assembling reusable building blocks and algorithms, with the flexibility to let users introduce their own. Tangelo is backend-agnostic and enables switching between various backends (Braket, Qiskit, Qulacs, Azure Quantum, QDK, Cirq...) with minimal changes in the code. The package can be used to explore quantum computing applications such as open-shell systems, excited states, or more industrially-relevant systems by leveraging problem decomposition at scale. This paper outlines the design choices, philosophy, and main features of Tangelo.

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