Retraction: Exploring the intermolecular interactions in carbon disulfide dimer: An ab initio study using an improved Lennard–Jones potential energy surface for physical insights

IF 1.9 4区化学 Q2 CHEMISTRY, ORGANIC Journal of Physical Organic Chemistry Pub Date : 2024-01-11 DOI:10.1002/poc.4597

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Abstract

Waqas Amber Gill¹ | Muhammad Usman Khan² | Zunaira Shafiq³ | Muhammad Ramzan Saeed Ashraf Janjua³

Gill, W. A., Khan, M. U., Shafiq, Z., Janjua, M. R. S. A., “Exploring the Intermolecular Interactions in Carbon Disulfide Dimer: An Ab Initio Study Using an Improved Lennard-Jones Potential Energy Surface for Physical Insights,” J Phys Org Chem 2023, https://doi.org/10.1002/poc.4548. The above article, published online on 05 June 2023 on Wiley Online Library (wileyonlinelibrary.com), has been retracted by agreement between the journal's Editor in Chief, Professor Rik Tykwinski, and John Wiley and Sons LLC. The journal's Editor-in-Chief was contacted by a third party who raised concerns about the article. An independent scientific expert evaluated the article and confirmed that significant problems exist with the data and conclusions of the work, and that it contains inadequate and/or inaccurate citations. As a result, the editors consider the article's conclusions to be unreliable.

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撤回：探索二硫化碳二聚体中的分子间相互作用：利用改进的伦纳德-琼斯势能面进行ab initio研究，以获得物理见解

Waqas Amber Gill1 | Muhammad Usman Khan2 | Zunaira Shafiq3 | Muhammad Ramzan Saeed Ashraf Janjua3Gill, W. A., Khan, M. U., Shafiq, Z., Janjua, M. R. S. A.、"探索二硫化碳二聚体中的分子间相互作用：使用改进的伦纳德-琼斯势能面进行物理洞察的 Ab Initio 研究"，J Phys Org Chem 2023, https://doi.org/10.1002/poc.4548。上述文章于 2023 年 6 月 5 日在线发表于 Wiley Online Library (wileyonlinelibrary.com)，经该刊主编 Rik Tykwinski 教授和 John Wiley and Sons LLC 协议，已被撤回。第三方联系了期刊主编，提出了对该文章的担忧。一位独立的科学专家对文章进行了评估，确认文章中的数据和结论存在重大问题，引用的资料不充分和/或不准确。因此，编辑认为该文章的结论不可靠。

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来源期刊

Journal of Physical Organic Chemistry 化学-物理化学

CiteScore

3.60

自引率

11.10%

发文量

161

审稿时长

2.3 months

期刊介绍： The Journal of Physical Organic Chemistry is the foremost international journal devoted to the relationship between molecular structure and chemical reactivity in organic systems. It publishes Research Articles, Reviews and Mini Reviews based on research striving to understand the principles governing chemical structures in relation to activity and transformation with physical and mathematical rigor, using results derived from experimental and computational methods. Physical Organic Chemistry is a central and fundamental field with multiple applications in fields such as molecular recognition, supramolecular chemistry, catalysis, photochemistry, biological and material sciences, nanotechnology and surface science.

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