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[物化]量子化学
1、fluorous chemistry───氟化学
2、quantum mechanics───[量子]量子力学（解释次原子粒子运动和质量）；n.量子力学
3、quantum number───[量子]量子数
4、inorganic chemistry───[无化]无机化学
5、chemistry───n.化学；化学过程
6、quantum mechanic───量子力学
7、azimuthal quantum───方位量子
8、quantum computer───[计]量子计算机
9、quantum physics───n.[量子]量子物理学；量子力学
1、In the paper the electronic structures of the template molecules are discussed through quantum chemistry calculation.───同时采用量子化学的方法对活性构象模板分子电子结构作了讨论。
2、Analyzing the characteristics of CVD process, the main calculation in quantum chemistry methods was introduced.───本文分析了化学气相沉积过程的特点，并对量子化学计算的主要方法进行介绍。
3、In principle, it is possible with the development of quantum chemistry and computing technology.───量子化学和现代计算技术的发展，已基本上能满足这一要求。
4、Significant biological applications of quantum chemistry are on the increase.───量子化学的重要生物学应用正在不断增加。
5、Density functional theory (DFT) of quantum chemistry was briefly introduced.───简要介绍了量子化学中的密度泛函理论。
6、The present work provides a useful way to deal with quantum chemistry calculations of the kind of molecular crystals like urea.───提供了一种解决分子晶体量子化学理论计算的新思路。
7、In Chapter II, the quantum chemistry theory, the topological analysis of electron density and the relevant dynamics theory are summarized.───第二章介绍了现代量子化学基本理论、量子拓扑学原理及动力学的相关理论。
8、Quantum chemistry methods and molecular modeling technology are the main branches of the computational chemistry.───量子化学方法和分子模拟是计算化学的主要分支。
1、Quantum chemistry methods and molecular modeling technology are the main branches of the computational chemistry.
2、This paper discusses the quantum chemistry ab initio calculation method and some semi-empirical calculation methods frequently used on the electronic structure.
3、To find out the modification method for removing the cyanogens group of ricinine , the basic quantum chemistry parameter of ricinine was calculated and the bond energy of the molecule was analyzed.
4、Metal-free indoline dyes for dye-sensitized solar cells were studied by employing quantum chemistry methods.
5、The method of Quantum chemistry provides a new thought and method for the research of biomolecule field.
6、In order to investigate further its ice- nucleating mechanism, molecular electronic structure has been computed by use of quantum chemistry method of CNDO/2.
7、Significant biological applications of quantum chemistry are on the increase.
8、The absorption spectrum by using CIS method of quantum chemistry calculation agrees with the experimental spectrum.
9、CNDO/2 quantum chemistry calculation method was used to explain the results of acid dissociation constant measurements.