Using high pressure to understand the behavior of organic molecular crystals

IF 2.9 2区材料科学 Q2 CHEMISTRY, MULTIDISCIPLINARY

IUCrJ Pub Date : 2025-01-01 DOI:10.1107/S2052252524012478

María Guadalupe Vasquez-Ríos

引用次数: 0

Abstract

In the recent publication by Zhou et al. [(2025). IUCrJ, 12, 16–22], the crystal structure of benzo[a]pyrene was studied under high pressure up to 28 GPa using single-crystal X-ray diffraction and DFT calculations. This commentary highlights the importance of high pressure for analyzing organic molecular crystals.

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利用高压来了解有机分子晶体的行为。

在Zhou等人最近发表的[(2025).]IUCrJ, 12, https://doi.org/10.1107/S2052252524010455]，利用单晶x射线衍射和DFT计算研究了在高达28 GPa高压下苯并[a]芘的晶体结构。这篇评论强调了高压对分析有机分子晶体的重要性。

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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来源期刊

IUCrJ CHEMISTRY, MULTIDISCIPLINARYCRYSTALLOGRAPH-CRYSTALLOGRAPHY

CiteScore

7.50

自引率

5.10%

发文量

审稿时长

10 weeks

期刊介绍： IUCrJ is a new fully open-access peer-reviewed journal from the International Union of Crystallography (IUCr). The journal will publish high-profile articles on all aspects of the sciences and technologies supported by the IUCr via its commissions, including emerging fields where structural results underpin the science reported in the article. Our aim is to make IUCrJ the natural home for high-quality structural science results. Chemists, biologists, physicists and material scientists will be actively encouraged to report their structural studies in IUCrJ.