| 用Origin 6.0绘制波函数平面图形 |
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| 引用本文： | 张建华,苏育志,宋建华,郭海燕.用Origin 6.0绘制波函数平面图形[J].计算机与应用化学,2003,20(4):467-470. |
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| 作者姓名： | 张建华 苏育志 宋建华 郭海燕 |
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| 作者单位： | 广州大学生物与化学工程学院化学系,广东,广州,510405 |
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| 摘 要： | Origin6．0作为一个数学软件平台，集数据管理与分析、二维及三维函数和离散数据绘图、程序开发等多功能于一体，广泛用于科学研究和工程计算。本文利用Origin6．0软件的函数绘图功能，绘制氢原子径向波函数、径向密度函数、径向分布函数、氢原子轨道及电子云的角度分布、杂化轨道等二维图形。给出了波函数的软件可读化形式和绘图的实际操作过程。与其它函数绘图方法相比，界面更友好，操作更方便。
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| 关 键 词： | Origin6.0 图形绘制 波函数平面图形 计算机 原子 分子 电子结构 径向密度 杂化轨道 |
| 文章编号： | 1001-4160(2003)04-467-470 |
| 修稿时间： | 2002年11月21 |
Two dimensional graphs of the wave functions in Origin 6. 0 |
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| ZHANG Jian-Hua,SU Yu-Zhi,SONG Jian-Hua,GUO Hai-Yan.Two dimensional graphs of the wave functions in Origin 6. 0[J].Computers and Applied Chemistry,2003,20(4):467-470. |
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| Authors: | ZHANG Jian-Hua SU Yu-Zhi SONG Jian-Hua GUO Hai-Yan |
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| Abstract: | Origin 6.0 is a mathematical software system and is widely used for various purposes such as data analysis and management, two and three dimensional function and scatter data plotting, and program development in scientific research and engineering design. Two dimensional graphs of wave functions and probability densities such as radial wave functions and their distributions, angular wave functions for the hydrogen-atom and hybrid orbits are made by the 2D-function-plotting in Origin 6. 0 on PC in this paper. The software readable expressions of various wave functions mentioned above and plotting operation procedure are given here. The Plotting operation interface is more friendly in comparison with other software. |
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| Keywords: | wave functions origin software computer function-plotting |
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