双分子的

These results reveal that, as an intrinsic property of the wave function of atoms, the angle of the probability distribution of the angular two-electron density is approximately equal to the bond angle of the molecular which usually can be explained by the hybridization theory.

结果显示，作为原子波函数的内禀性质，双电子密度最可几角分布的角度与通常由分子杂化轨道理论解释的相关原子的分子的结合键角近似相等。

The close coupling calculation of rotationally inelastic collision of He with Na_ 2 is first performed by employing a recently computed ab initio potential energy surface.

在已经拟合好的He-Na2体系势能面上，根据原子-双原子分子的非反应性碰撞动力学的相关基本理论，在空间固定坐标系下，采用严格的密耦方法求解了He原子和Na2分子的转动非弹性碰撞动力学方程。

The results showed that enhancing monomolecular reactions could be favorable for increasing the propylene content in LPG, but the dry gas yield increased significantly.

结果表明，强化单分子反应有利于液化气中丙烯含量的提高，但干气产率也会同时增加；而一定程度上促进双分子反应，尤其是负氢离子转移反应的发生有助于抑制干气的生成，但程度太高时却不利于丙烯的生成。

The copper atom is in a planar coordination site of [N_2O_2] and it devites from the mean plane by only 0.80 pm. Byπ-πstacking interactions, a alabastrine structure was obtained.(2)Schiff-base complex [Cu(H_2O)]·H_2O, where H3GS is the 3-carboxyl -salicylidene glycine, was synthesized and characterized by elemental analysis, IR spectra and single-crystal analysis. The crystal belongs to monoclinic system, space group P2(1)/c, a=848.46(3)pm, b=681.54(3)pm, c=1967.16(8)pm,β=95.8210(10)°, Z=4, R_1=0.0279, wR_2=0.0724. The copper atom is in a square-pyramidal field with the base

结果表明该晶系属单斜晶系，空间群P2(1)/c，晶胞参数：a=848.46(3)pm，b=681.54(3)pm，c=1967.16(8)pm，α=90°，β=95.8210(10)°，γ=90°，Z=4，R_1=0.0279，wR_2=0.0724，Cu原子位于轻微变形的四方锥场底心，底面被氮原子、酚氧原子、甘氨酸羧基的一个氧原子和一个水分子氧原子占据，而甘氨酸羧基的另一个氧原子占据相邻分子的锥顶，因而形成一维链状结构；合成了单核双聚配合物Na_2[Cu_2_2]·2H_2O ，铜三核配合物Cu_3_2·5H_2O和铜锌异三核配合物ZnCu_2_2·5H_2O，并用元素分析，IR光谱，电子光谱和磁化率测定对配合物的组

These data were used to infer the molecular formula and the elemental compositions of all the fragmental ions through software interpretation and, by further applying fragmentation regularities of mass spectrometry, the majority of ions were fully assigned. A base peak at m/z 402 in the mass spectrum was found as the molecular ion. The fragments were created mainly from the fragmentations of the tetrahydrofuran rings and the hydroxyl group. The most fragment products contain the dimethoxy phenyl group.

利用这些数据通过软件导出了分子式和所有碎片离子的元素组成，由此进一步根据质谱裂解规律对石梓醇分子的电子轰击质谱的主要裂解碎片给出了完全的归属，质谱中发现基峰为分子离子峰(m/z402)，裂解碎片主要来自双骈四氢呋喃环的裂解和羟基引起的裂解，绝大部分裂解产物包含二甲氧基苯基基团。

The magnetite with a mean diameter of 8nm was prepared by chemical coprecipitation methods. By the addition of nonionized oleic acid to the suspension of magnetite in solution during precipitation, the magnetite nanoparticles were coated with a double surfactant layer. A gel-like precipitated precursor is then formed because of the hydrophobic interaction among those coated units. By transferring of this precursor to an organic solvent, the surfactant double layer on Fe〓O〓 nanoparticles reduces to one; however, it still remains as a double layer by transferring to an alkaline aqueous solution. Both these cases give in stable colloids of superparamagnetic Fe〓O〓 nanoparticles.

从解决无机磁性Fe〓O〓颗粒与有机烯类单体的相容性入手，采用化学共沉淀法，制备了平均直径为8nm的超顺磁性Fe〓O〓颗粒，在制备过程中以非离子形式引入油酸，在Fe〓O〓颗粒表面形成一个具有双层结构的疏水外壳，并通过疏水相互作用凝聚成磁性Fe〓O〓凝胶，能够以单分子层结构形式溶解在非极性溶剂中，也能够以双分子层结构形式溶解在碱性水溶液中，形成稳定的超顺磁性Fe〓O〓溶胶。

The crystal consists of two similar but independent molecules in the asymmetric unit and the Ce ion coordinated toward ten donor atoms, six of which belong to the nitrogen atoms of two tridentate ligands and four oxygen atoms from two bidentate picrates.

晶体中一个不对称单元内有两个结晶学上独立的分子，这两个分子的构型基本相同，中心Ce3＋均与两个三齿配位的配体及两个双齿配位的苦味酸根配位，配位数为10。

In addition, the free group of negative ion came into being as a result of charge transfer between C=O band of vitamin M molecules and silver particles, and the C=O band was opened.

实验结果表明，VM在银表面的吸附发生在COO-基团，并且VM分子的C=O与银发生电荷转移后形成负离子自由基，碳氧双键打开，同时受VM分子吸附在银胶表面的影响，苯环结构发生了很大的扰动。

With the high sensitivity and high resolution of the CO intracavity Laser Magnetic Resonance spectrometer, the high-resolution spectra of the rare isotope molecule ~(15)N~(16)O in natural abundance were successfully observed, which provided experimentai data for the analysis of the hyperfine structure of NO molecule.

通过对中红外CO内腔激光磁共振光谱仪的改造，我们大大提高了该谱仪的探测灵敏度和分辨率，并成功用于探测NO稀有同位素分子~(15)N~(16)O的超高分辨光谱，为该分子的超精细结构和Λ-双分裂分析提供了实验依据。

Isobutane can be chemisorbed on surface terminal oxygen of Lewis base sites M=O bonds by one or two H atoms in-CH〓.

异丁烷分子以CH〓中C-H键的H端单位或双位吸附于催化剂表面Lewis碱M=O双键的端氧位。

The labia have now been sutured together almost completely.The drains and the Foley catheter come out at the top.

此刻阴唇已经几乎完全的缝在一起了，排除多余淤血体液的管子和Foley导管从顶端冒出来。

To get the business done, I suggest we split the difference in price.

为了做成这笔生意，我建议我们在价格上大家各让一半。