Molecular structure of propadiene as seen from ab iintio calculation in quantum chemistry 丙二烯分子结构的量子化学从头计算
Theoretical study on the addition reaction for dichlorocarbene with carbon monoxide 二氯卡宾与一氧化碳加成反应机理的量子化学研究
Synthesis of n - methyl - 2 - 4 - formylphenyl - 3 , 4 - 60 pyrrolidine and its quantum chemical calculation 60吡咯烷衍生物的合成及量子化学计算
A quantum chemical study on the electrochemical synthesis of sorbic acid precusors 电化学法合成山梨酸前体乙酰氧基己烯酸的量子化学研究
Ab initio study on potential energy function and vertical ionization potential for puo molecule 分子势能函数与垂直电离势的量子化学计算
The calculation of the quantum chemistry shows the reaction mechanism of the condensation reaction 利?量子化学计算方法讨论了该缩合反应的机理。
Quantum chemical study on structures and properties of chiral thiazolidino 3 , 4 - c oxazaborolidine catalyst 噻唑烷并手性口恶唑硼烷催化剂结构和性质的量子化学研究
A quantum chemistry study on the electronic structure of flotation reagents and its coordination with sulphide ore 黄药类浮选药剂电子结构与浮选机理的量子化学研究
The emphases in this paper are focused on the important chemical processes and quantum chemical calculation on the formation of secondary organic aerosols 本文将重点介绍二次有机气溶胶形成的重要化学过程和量子化学计算研究。
Thus , electrochemical and quantum chemical methods were applied to deeply study phosphorus generation mechanism and influencing factors in this paper 本文采用电化学及量子化学手段,对化学镀镍磷过程中磷的析出机理及影响因素进行了深入的探讨。
