The Molecular Orbital Method的意思|示意
分子轨道法
The Molecular Orbital Method的网络常见释义
分子轨道理论 ...偶极矩大小 SS成分越多 成分越多,,电负性越大 电负性越大 12 1.3 1.3 分子轨道理论 分子轨道理论 (The Molecular Orbital Method) 分子轨道理论的描述 分子中成键电子不是定域在特定原子间,而是 分布在能量不连续的一系列分子轨道之间。
The Molecular Orbital Method相关例句
Ab initio molecular orbital method has been employed, in this paper, to study the mechanism of the hydrolysis of acetylcholine.
本文对乙酰胆碱水解反应历程进行了从头算分子轨道研究。
The molecular orbital coefficients are determined by means of a semiempirical method in the calculation.
计算中,用半经验方法确定了分子轨道系数。
The electronic structure of products and reactants were studied by molecular orbital PM3 method. The reaction enthalpies and optimized configuration for products were obtained.
用半经验的量子化学PM3方法研究了反应物和产物的电子结构,得到了产物的最优构型和电荷键序分布以及反应焓变。
Ab initio molecular orbital method has been empolyed, in this paper, to study the mechanism of the hydrolysis of acetylcholine.
本文对乙酰胆碱水解反应历程进行了从头算分子轨道研究。
The reaction mechanism of 4-methyl-5-ethenyl-heptanitril e oxide cycloaddition is studied with the molecular orbital AM1 method and transit ion state theory.
用过渡状态理论和量子化学AM1方法,对4 甲基5 烯庚腈氧化物环加成反应机理进行了研究。
The reaction mechanism of 8-dimethyl-7-methoxy-5-ethenyl-nonanenitrile oxide cycloaddition has been studied with the molecular orbital AM1 method and transition state theory.
用过渡态理论和AM 1方法,对8-二甲基- 7-甲氧基- 5 -烯-壬腈氧化物分子内环加成反应机理进行了研究。