But we also could write it as the sum over I, where this now is molecular energy levels i. 但是我们也可以写成对i的求和,这里i代表分子的能级。
The relationship between the molecular orbitals energy levels and the biochemistry properties, electron spectrum are discussed. 分析分子轨道能级与生化性质和电子光谱的关系。
Raman spectrum is an important analytic method of modern laser spectral technique, for the sake of its special advantages ( e.g. independent of molecular energy levels), it is applied widely in solution, gases, isotopes, elemental crystal and so on. 拉曼光谱是现代激光光谱技术中的一种重要的分析方法,由于它的一些优点(例如不受分子能级的限制等),再溶液、气体、同位素、单晶等方面的应用具有突出的优势。
It's an effective technique in studying molecular energy levels, analyzing material compositions, and detecting environmental pollutants. 该方法在电离与探测过程中实现了光谱与质谱双重选择,具有高灵敏度、高分辨率、多组分探测等优点,在分子能级结构研究、物质成分分析、环境污染检测等方面有重要应用。
The frontier molecular orbital characteristics and energy levels of BeQ_2 have been analyzed systematically in order to study the electronic transition mechanism. 系统分析了分子结构、前线分子轨道特征和能级分布规律以探索电子跃迁机理。
Molecular Orbitals and Energy Levels of Heteronuclear Conjugated Molecules 含杂共轭分子的轨道与能级
Have put forward graph theory method for determining the Huckel molecular orbits and the calculation of energy levels for conjugated molecules. ckel分子轨道和能级计算,唐敖庆等提出了图论法。
But neither can give a method for calculating the molecular energy levels and charge density of liquid crystals. 但是还没有关于液晶分子能级和电荷密度的计算方法。
Quantity estimate of double atomic molecular energy levels 双原子分子能级差的数值估算
The analysis of the molecular orbital bond character on lower energy levels in diatomic molecules 双原子分子低能级分子轨道成键性质分析
The limiting factors of the photovoltaic performances include the narrow absorption band, the low molar absorption coefficient, the unmatched molecular energy levels and the low charge-carrier mobility of the polymer donor materials. 对聚合物给体材料来说,限制其光伏性能的因素包括吸收光谱窄、摩尔吸光系数低、分子能级不匹配及载荷子迁移率低等。
Some results were obtained according to the calculation as follows: the thought to analyze the molecular orbital energy levels of the donors and the acceptors to select the porphyrin sensitizer candidates is practical. 2. 结果表明:利用分子轨道能级筛选敏化剂候选体的思路是可行的。
By changing the donor units, the band gaps and HOMO ( the highest occupied molecular orbital) energy levels of the copolymers could be finely tuned. 改变不同的给体单元,可以调节其带隙和HOMO能级。