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- The Modified Configuration Interaction method(MCI)is used to calculate the correlated energy of multi-electron systems. 用组态相互作用方法计算了二电子体系电子关联能。
- Abstract The reaction mechanism of fulgide photochromism was investigated by PM3 semiempirical quantum chemistry method and MECI configuration interaction method in this paper. 摘要 采用PM3半经验量子化学计算方法和组态相互作用方法(MECI) ,通过逐点改变俘精酸酐分子开关化学键的键长 ,成功计算了呋喃取代的俘精酸酐分子开环体和闭环体沿基态、第一单重激发态和第一三重激发态互变的势能变化曲线。
- By using an accurate ab initio MELD program, under the level of configuration interaction, the boundary radii of the first excited states of atoms from first-to fifth-row in the periodic table are evaluated. 利用MELD精密从头计算程序,在组态相互作用水平下,计算第一至第五周期元素的原子第一激发态的边界半径。
- Configuration Interaction in Valence Bond Theory 价键理论中的组态相互作用
- muhireference configuration interaction 多参考组态相互作用
- limited configuration interaction 有限构型相互作用
- limited configuration interaction (LCI) 有限构型相互作用
- quadratic configuration interaction method 二次组态相互作用方法
- Pair Natural Orbital Configuration Interaction 天然双轨结构互作用
- Multi-reference configuration interaction 多参考组态相互作用
- configuration interaction method 组态相互作用法
- Mother and baby interact in a very complex way. 母亲与婴儿以非常复杂的方式相互影响。
- Geometry optimization and natural bond orbital analyses for Re2(edt)4 were carried out with B3LYP method. Molecular orbitals and excited states for Re2(edt)4 were calculated with single excitation configuration interactions (CIS) method. 用密度泛函理论中的B3LYP/CEP-4G方法对Re2（edt）4进行了结构优化和自然键轨道计算,并用单电子激发组态相互作用方法（CIS）计算了Re2（edt）4的分子轨道和激发态。
- All things are interrelated and interact on each other. 一切事物互相联系并互相作用。
- The low gear configuration of a transmission. 低速齿轮传动的低速齿轮构造
- Interaction between systems or between properties of a system. 系统间或一个系统的各种特性之间的相互作用。
- Something resembling this structure in configuration or pattern. 蜂窝状物在外形或结构上类似这种构造的东西
- Configuration interaction applied to resonant states in semiconductors and semiconductor nanostructures 应用于半导体结构及半导体纳米结构谐振状态相互作用构型
- To react or interact harmoniously. 投合，契合合谐地做出反应或回应
- Having equal numbers of electrons or the same electronic configuration. 等电子的有相同的电子数目的或有相同的电子构型的
