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- In this paper,we have shown that the coefficients of LCAO MO of molecules withperiodical structures can be splitted into two factors,one indicating the positions andthe other the physical properties of the atoms. 本文指出;具有周期性结构的共轭分子 LCAO MO 分子轨道系数可以分解为两个因子;一个为反映原子轨道的几何位置的相位因子;一个为反映原子轨道的性质及原子结构情况的物理因子.;相位因子是由原子在分子中的几何位置完全确定的因子
- The search for accurate electronic wave functions of polyatomic molecules uses mainly the MO method. 寻求多原子分子的准确电子波函数主要用mo法。
- The reasoning is involved, in contrast with the very natural explanation given by the MO method. 与MO法给出的很自然的解释比较起来，论证是复杂的。
- The band structures of ten semiconductors of A,AB and AB2 types have been calculated by LCBO MO method. 本文用LCBO MO法计算了属于元素半导体和AB型、AB_2型化合物半导体的十种共价结构的能带。
- In the present paper the conjugated bond network formed by two kinds of component atoms of alternate coordination in AB type binary compound has been treated by LCBO MO method. 本文用LCBO MO法探讨了由两组原子交替配位以单纯的共轭键网络结合的AB型单质和化合物晶体的电子态,这类单质和化合物分别属于层状BN结构、CsCI结构和NaCI结构。
- Using the parameters which were obtained by ab initio HF (STO-3G) MO method, the mechanism of the reaction of t-butyl hydroperoxide (BHP) with N, N-dimethyl aniline (DMA) was discussed. 本文由从头算Hartree-Fock(STO-3G)MO法来探讨叔丁基过氧化氢(BHP)与N,N-二甲苯胺(DMA)的反应机理。 该反应是由如下三种反应组成的。
- Keywords TASO LCAO MO symmetry overlapping energy level geometric structure; 对称性;非零重叠;能级;几何构型;
- The method seems good but it needs to be tried out. 这个方法似乎不错，但需要试验一下。
- Keywords Propene;Methylcyclopentane;Ab initio Mo method;UMP_2; 丙烯;甲基环戊烷;从头算分子轨道法;UMP_2;
- Keywords ASED MO method;catalyst structure;thermal stablility; MO理论;催化剂结构;热稳定性;
- Keywords copolymer Rh complex;ASED MO method;oxidative addition; 共聚物铑配合物;ASED-MO理论;氧化加成;
- It's all over now so think mo more of it. 现在一切都过去了，因此别再去想它了。
- Half a mo (ie Wait a little), I'm not quite ready. 等一下，我还没完全准备好。
- I can't claim infallibility for this method. 我不敢说这方法绝对有效。
- Keywords spiro [2;3] hexane;hydrogenolysis;mechanism;ab initio;MO method; 螺环[2;3]己烷;氢解;反应机理;从头算;分子轨道法;
- Summer fallow is the best method of destroying weeds. 夏季休耕是消灭杂草的最好办法。
- Popularizing this new method is not an easy job. 推广这种新方法不是件容易的工作。
- This is not an economical method of heating. 这不是一种经济的取暖方式。
- I have a simple and easy method. 我有个简易的方法。
- I went through by a summary method. 我成功运用了一个简易的方法。
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- 深远海浮式风电平台 - deep-sea floating wind power platform
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