查询词典 atomic bond

The formation situation of the band for transition metallic carbonyl cluster compounds is analysed with the bond valence formula for atomic cluster compounds.

本文运用原子簇化合物键价计算公式，对过渡金属羰基簇合物成键情况进行了分析，利用金属键轨道数，价非键轨道数和金属配体成键轨道数计算簇合物价轨道总数。

Besides, influence of atomic number on the numbers of residual bond and short-range order atom also was analysed.

同时，分析了原子序数对熔体中剩余键数和近程有序原子数的影响。

This implies that the atomic near neighbour distance of metallic bond solid solution is the closet to VCA model among the three solid solutions, although the vegard's law are not followed.

离子键固溶体中第一近邻距随成分的变化量只有近邻距Vegard定律变化量的40％左右，而共价键固溶体只有20％左右，金属键固溶体的变化量最大，一般都在50％以上，甚至高达80％左右。

Chemical bonds and structural theory of organic chemistry 6 class hoursKnow the history of organic chemistry; Grasp the basic theory of organicchemistry, such as structural theory, chemical bonds, resonance theory, atomic andmolecular orbital theory, and valence bond theory; understand polar and non-polarcompounds, dipole moment and know how to express the structures of organiccompounds with different molecular formulas.

了解有机化学发展简史；掌握有机化学结构理论、化学键理论、共振理论、原子和分子轨道理论和杂化轨道理论；了解极性和非极性分子并掌握有机化合物结构的表示法。

In this paper, a Si-doped armchaired single-walled carbon nanotube (7, 7) and a perfect SWCNT (7, 7) are investigated using the classical molecular dynamics simulations method. The inter-atomic short-range interaction is represented by empirical Tersoff bond order potential.

用分子动力学方法对扶手椅（7，7）单壁碳纳米管掺杂下的结构和力学性能进行了计算机模拟研究，在分子动力学模拟中，采用Tersoff 短程相互作用势描述原子间的相互作用。

In this research, large volume stainless pots, high－quality pottery pots and enamel pots, instead of traditional small volume pottery pots, were used in storing several kinds of fresh liquor like "Shuanggou Liquor" etc.and the analysis of stored liquor by gas chromatography and atomic absorption spectrum indicated that the application of large volume stainless containers, instead of the traditional pottery pots, could not only advance liquor aging , produce flavour and remove precipitate, develop soft liquor style, stabilize and improve liquor quality,harmonize the balance of components , decrease liquor loss and liquor storage space,but also promote oxidation , reduction, esterification and molecular hydrogen bond association in the process of liquor storage.

对&双沟酒&等各香型酒，利用大容器的不锈钢罐、优质陶缸和搪瓷罐代替传统小容积陶坛或陶缸贮存新酒作了试验研究。采用气相色谱和原子吸收光谱对贮酒分析，得出采用不锈钢等大容器代替传统小陶罐贮存酒，不但可使酒在贮存过程中进行氧化、还原、酯化和分子氢键缔合作用，促进酒体老熟去杂增香，使酒体柔和老熟、成分平衡协调，稳定和提高酒质；而且还可以降低酒的损耗和减少贮酒库占地面积。孙悟

Three parameters of lanthanide,atomic number Z,valence electron number N,ion radius r,were used to define a new topological index of bond parameter —H_z.

根据镧系元素的原子序数Z、价电子数N、离子半径r提出了一个新的键参数拓扑指数 HZ，并将HZ、镧系元素相对分子质量Mr共同与其11种理化性质进行关联，其结果显示了满意的线性相关性。

The diagnostic vibrational modes of these complexes were predicted and assigned. Bond length, total atomic charge, frontier molecualr obital energy, molecular obital coefficience, and Mullicken Bonding Population demonstrated that electron transfer should have happened from benzene to ammonium, and therefor the charge-transfer complex should be formed.

通过复合物中的键长、原子净电荷、分子轨道能量和系数、Mullicken成键布居等量子化学参数的分析得出了铵和苯环碳原子发生作用而形成电荷转移复合物，铵和苯之间的作用包含s-π相互作用的结论。

Bond length, total atomic charge, frontier molecualr obital energy, and Mullicken Bonding Population proclaimed that electron transfer ought to be possible from benzene to ammonium to form charge-transfer cpmplexes. The molecular obital coefficience showed that the p-π initeraction must be existed between alkali metal cation and benzene.

键长、原子净电荷、前线轨道能量和分子轨道系数、Mullicken成键布居等量子化学参数表明碱金属阳离子和苯环碳原子发生作用而形成电荷转移复合物，这种作用中包含p-π作用的形式。

The novel molecular topological index was recommendedrelating to such atomic properties as electronegativity,electron number of valence shell,number of bonding electrons,the main quantum number of valence shell and bond length.

采用该拓扑指数对饱和烷烃、烷基苯、烷氧氯硅烷、卤代苯、含氮杂环化合物、碱金属卤化物及卤化锡的性质/活性进行了相关关系的研究。

Since historical times,England ,where the early inhabitants were Celts, has been conquered three times .

从有历史以来，英国，在此地早期居住的是凯尔特人，已经被征服了三次。

Bluetooth OBEX File Transfer Enables the sending and receiving of files on your phone via Bluetooth.

蓝牙OBEX文件移动允许经过蓝牙传送和接受文件。。。。