结构化学课程中波函数3D图的VRML实现

doi:10.3866/PKU.DXHX201812002

University Chemistry ›› 2019, Vol. 34 ›› Issue (7): 100-104.doi: 10.3866/PKU.DXHX201812002

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VRML Presentation of 3D Wave Functions in Structural Chemistry

Hongwei SUN*(),Lan CHEN

College of Chemistry, Nankai University, Tianjin 300071, P. R. China

Received:2018-12-04 Published:2018-12-21
Contact: Hongwei SUN E-mail:sunhw@nankai.edu.cn
Supported by:
南开大学教学改革项目

Abstract

Abstract:

Using three-dimensional (3D) graphing and molecular modeling softwares, the procedures for presenting the VRML 3D wave functions have been discussed. The interactivities of VRML can help students to observe the characters of wave functions intuitively, which also improve the teaching results of quantum chemistry and electronic structures effectively.

Key words: Wave functions, Three-dimensional (3D), VRML, Structural chemistry

Hongwei SUN,Lan CHEN. VRML Presentation of 3D Wave Functions in Structural Chemistry[J].University Chemistry, 2019, 34(7): 100-104.

1	Atkins, P.; Paula, J. Physical Chemistry, 9th ed.; W. H. Freeman and Company: New York, 2010.
2	Clark Dailey surfx3d Downloads.[2018-10-08]. https://www.fileheap.com/software/clark_dailey_surfx3d.html.
3	Orbital Viewer.[2018-10-08]. http://www.orbitals.com/orb/ov.htm.
4	肖信; 袁中直. 大学化学, 2003, 18 (4), 41.
5	MOLDEN a visualization program of molecular and electronic structure.[2018-10-15]. http://www.cmbi.ru.nl/molden/.
6	Cortona3D Viewer.[2018-11-21]. http://www.cortona3d.com/cortona3dviewer/.
7	孙宏伟; 陈兰. 大学化学, 2018, 33 (2), 70.
8	南开大学结构化学精品课程网站.[2018-11-21]. http://struchem.nankai.edu.cn/.

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VRML Presentation of 3D Wave Functions in Structural Chemistry

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