계산과학플랫폼 기반 온라인 양자화학 실험 환경 개발

This paper introduces an online experiment environment based on a computational science platform that can be used for various purposes ranging from basic education to quantum chemistry and professional quantum chemistry research. The simulation environment was constructed using a simulation workbenc...

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Bibliographic Details
Published in:Inteonet jeongbo hakoe nonmunji = Journal of Korean Society for Internet Information 2020-10, Vol.21 (5), p.97-107
Main Authors: 전인호, Inho Jeon, 온누리, Noori On, 권예진, Yejin Kwon, 서정현, Jerry H. Seo, 이종숙, Jongsuk R. Lee
Format: Article
Language:Korean
Subjects:
Computational chemistry
Computational Science Application
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Summary:This paper introduces an online experiment environment based on a computational science platform that can be used for various purposes ranging from basic education to quantum chemistry and professional quantum chemistry research. The simulation environment was constructed using a simulation workbench and simulation workflow, which are execution environment services of Science App provided by the computational science platform. We developed an environment in which learners can learn independently without an instructor by selecting experiment topics that can be used in various areas of chemistry, and offering the learning materials of the topics in a form of e-learning content that includes theory and simulation exercises. To verify the superiority of the proposed system, it was compared with WebMO, a state-of-the-art web-based quantum chemistry simulation service.
ISSN:1598-0170
2287-1136