1·This text is designed as a practical introduction to quantum chemistry.
这份正文被设计为实际的量子化学的介绍。
2·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。
3·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。
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·The hydrogenlike atom is the single most important system in quantum chemistry.
类氢原子在量子化学中是独特的而最重要的体系。
6·Quantum chemistry method is used to study the reactivity of the methanol dehydration.
用量子化学方法，研究甲醇脱水的反应性。
7·They have also released a special version of the CD with tools for molecular quantum chemistry.
另外还发布了一个特殊版本的 CD，内有分子量子化学的工具。
8·Topics of study include quantum chemistry and computer simulation of structures and actions.
课程包括量子化学，计算机模拟结构和行为等。
9·The results are first elucidated by model cluster method and computational quantum chemistry method.
上述结果首次用模型簇和计算量子化学方法进行了解释。
10·The absorption spectrum by CIS method of quantum chemistry calculation agrees with the experimental spectrum.
由量化计算中的CIS方法所获得的吸收谱理论值与实验吻合地较好。