引用本文:
王延忻, 王宏娟, 石玉仁, 杨云霞. Python在结构化学可视化教学中的应用探索[J]. 大学化学,
2024, 39(3): 108-117.
doi:
10.3866/PKU.DXHX202306005
Citation: Yanxin Wang, Hongjuan Wang, Yuren Shi, Yunxia Yang. Application of Python for Visualizing in Structural Chemistry Teaching[J]. University Chemistry, 2024, 39(3): 108-117. doi: 10.3866/PKU.DXHX202306005
Citation: Yanxin Wang, Hongjuan Wang, Yuren Shi, Yunxia Yang. Application of Python for Visualizing in Structural Chemistry Teaching[J]. University Chemistry, 2024, 39(3): 108-117. doi: 10.3866/PKU.DXHX202306005
Python在结构化学可视化教学中的应用探索
English
Application of Python for Visualizing in Structural Chemistry Teaching
Abstract:
This paper explores the use of the Python language and scientific computing libraries to visualize the wave functions and electron clouds of common hydrogen atomic s and p orbitals in structural chemistry. Multiple scripts have been developed in this process, employing data processing and various generation algorithms to achieve the visualization of wave functions and electron clouds. The aim is to guide students in a comprehensive study and understanding of the physical significance of wave functions and electron clouds. This approach enhances students’ abilities for independent thinking and active learning.
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Key words:
- Structural chemistry
- / Python
- / Wave function
- / Electron cloud
- / Visualization
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