面向所有人的模拟:原子、分子和光学科学门户

IF 1.8 4区计算机科学 Q3 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS

Computing in Science & Engineering Pub Date : 2023-05-01 DOI:10.1109/mcse.2023.3312888

Kathryn R. Hamilton, Klaus Bartschat, Nicolas Douguet, Sudhakar V. Pamidighantam, Barry I. Schneider

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引用次数: 0

摘要

原子、分子和光学科学网关(AMOSGateway)使新手和有经验的用户能够利用最先进的软件套件来解决原子、分子和光学科学的核心问题。这种国际合作为计算研究提供了一个免费的平台和协调的方法，使社区能够以前所未有的规模产生新的科学成果。AMOSGateway目前拥有10个软件包，其先进的网络基础设施影响许多领域，包括量子信息、冷原子/分子、等离子体物理和天体物理学。未来的更新将通过图形用户界面进一步简化这些复杂的工具，从根本上改变从业者在前沿计算研究中获得专业知识的方式。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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Simulation for All: The Atomic, Molecular, and Optical Science Gateway

The Atomic, Molecular, and Optical Sciences Gateway (AMOSGateway) enables novice and experienced users to utilize state-of-the-art software suites for tackling problems central to atomic, molecular, and optical science. This international collaboration provides a free platform and coordinated approach for computational research, allowing the community to produce new scientific results on an unprecedented scale. Currently hosting 10 software packages, the advanced cyberinfrastructure of AMOSGateway impacts many areas, including quantum information, cold atoms/molecules, plasma physics, and astrophysics. Future updates will further simplify these complex tools through graphical user interfaces, fundamentally transforming how practitioners gain expertise in cutting-edge computational research.

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来源期刊

Computing in Science & Engineering 工程技术-计算机：跨学科应用

CiteScore

4.20

自引率

0.00%

发文量

审稿时长

6-12 weeks

期刊介绍： Physics, medicine, astronomy -- these and other hard sciences share a common need for efficient algorithms, system software, and computer architecture to address large computational problems. And yet, useful advances in computational techniques that could benefit many researchers are rarely shared. To meet that need, Computing in Science & Engineering presents scientific and computational contributions in a clear and accessible format. The computational and data-centric problems faced by scientists and engineers transcend disciplines. There is a need to share knowledge of algorithms, software, and architectures, and to transmit lessons-learned to a broad scientific audience. CiSE is a cross-disciplinary, international publication that meets this need by presenting contributions of high interest and educational value from a variety of fields, including—but not limited to—physics, biology, chemistry, and astronomy. CiSE emphasizes innovative applications in advanced computing, simulation, and analytics, among other cutting-edge techniques. CiSE publishes peer-reviewed research articles, and also runs departments spanning news and analyses, topical reviews, tutorials, case studies, and more.