大学化学2025，Vol.40Issue(3)：199-205,7.DOI:10.12461/PKU.DXHX202407011
量子化学计算和可视化分析在弱相互作用的教学中的应用
Application of Quantum Chemistry Computation and Visual Analysis in Teaching of Weak Interactions
摘要
Abstract
Weak interactions play a crucial role in the chemistry education and are often encountered when studying both intramolecular and intermolecular interactions.These include the effects of hydrogen bonding on melting/boiling points,acidity/basicity,and isomerism,as well as the influence of conjugation on stability.This paper focuses on specific examples commonly found in university-level chemistry courses.By employing quantum chemistry calculations and wave function analysis,intuitive visual representations are generated to aid students in understanding key concepts and theories.This work aims to provide materials and case studies for teaching both theoretical and experimental aspects of organic chemistry.关键词
弱相互作用/量子化学计算/可视化分析/氢键/化学教学Key words
Weak interaction/Quantum chemistry calculation/Visual analysis/Hydrogen bond/Chemistry teaching分类
社会科学引用本文复制引用
徐慧影,梁铭慧,周志,高辉,易伟..量子化学计算和可视化分析在弱相互作用的教学中的应用[J].大学化学,2025,40(3):199-205,7.基金项目
广东省研究生教育创新计划项目-学位与研究生教育改革研究(2022JGXM081) （2022JGXM081）
广东省研究生教育创新计划项目-研究生示范课程建设项目(2021SFKC070) （2021SFKC070）
2024年度广州医科大学全科医学与继续医学教育项目(广医大继[2024]1号) （广医大继[2024]1号）
