能量面

The results show that the most close-packed surface (111) orientation of FCC metals which have the lowest surface energies will grow preferentially, the surface energies for the all lattice surfaces increase linearly with increasing including angle between the surfaces and (111), which are consistent with the experimental and the linear muffin-tin-orbital-atomic-sphere-approximation results.

结果表明，FCC金属的密排面（111）的表面能最小，则该晶粒取向优先生长，与实验结果和第一原理的LMTO－ASA计算结果一致；各个晶面的表面能均随着其它晶面与（111）晶面的夹角的增长而呈线性增长关系，因此利用（111）面可推导出其他各面的表面能量。

Therefore, the moist potential vorticity analysis associated with the mesoscale convective system was researched in the paper, so as to reveal the moist potential characteristics of mesoscale convective system in typhoon circulation. The results showed that, during the generation stage, convective instability characterized by MPV1 was a favorable condition for forming MCS, while the vorticity which was caused by the slantwise isentropic surface and the vertical shear of the horizontal wind characterized by MPV2 was an inspiring mechanism. The specific process was that, the atmosphere exhibited the feature of strong convective instability at the low level of convection areas and the southeast areas, which included plenty of erratic energy. The slantwise ascended the stream transfer the erratic energy to northwest, where the stratification stability was small. As decreased, the cyclonic vorticity increased. On the other hand, the vorticity caused by the slantwise isentropic surface and the vertical shear of the horizontal wind inspired the release of convective instability and as a result that the MCS formed. During the development stage, the cyclonic vorticity increased quickly with the persistent decreasing of . Meanwhile, the inclination of isentropic linewas bigger than the absolute momentum line at middle level, which exhibited the feature of conditional symmetric instability , then the conditional symmetric instability was forced to release by the vorticity resulted from the slantwise isentropic surface and the vertical shear of horizontal wind, and the MCS developed.

结果表明，在对流形成阶段，MPV1即对流不稳定为MCS的形成提供背景不稳定条件，由MPV2即湿等熵面的倾斜和水平风的垂直切变而引起的涡旋发展作为强迫机制：MCS形成的区域及东南区域中低层是强对流不稳定层，蕴含丰富的不稳定能量，倾斜上升运动把对流不稳定区具有强不稳定能量的暖湿空气向西北中层的中性层结区输送，由于的减小，气旋性涡度增强，有利于形成对流，另一方面，由于湿等熵面倾斜和低空急流加强而引起的涡旋发展作为一种强迫机制激发对流不稳定能量得到释放，从而形成对流；在对流系统地发展阶段，由于低层的对流不稳定性进一步减弱，进一步减小，气旋性涡度进一步增强，有利于MCS的增强，中层等θe 线的倾斜度比绝对动量M 等值线的倾斜度大，对应有条件对称不稳定区域，满足条件对称不稳定条件，在湿等熵面倾斜和台风低空急流作用下引起的涡旋发展强迫对称不稳定能量释放，从而使得对流得以维持和加强。

The results show that rutile TiO_2 surface is the lowest energy surface.

计算结果表明(110)晶面为最低能量面。

School of Chemistry and Chemical Engineering, Central South University, Changsha 410083, China）Abstract: Based on the theoretic calculation of crystal faces (001),(100),(010),(011),(110),(101) and (112) of gibbsite by CASTEP program, the relationship between unfold character of crystal face and chemical bond strength of surface of gibbsite was investigated.

摘 要：用剑桥连续总能量软件包程序，对氢氧化铝的各个经常显露面族的(001)、(100)、(010)、(011)、(110)、(101)和(112)面进行理论计算，分析氢氧化铝晶体的晶面显露特征与表面化学键力的关系。

The results show that the energy state of gibbsite is more stable when faces (001),(101) and (100) are mainly unfold faces, while the energy state would be instable when face (010) is mainly unfolded.

计算结果表明，对于长大后的氢氧化铝晶体，当(001)，(101)和(100)面为主要显露面时，能量状态较为稳定；若(010)面显露较多，长大后的晶体的能量稳定性较差。

In this method, stability safety coefficient is derived from th e ratio fo internal energy to external energy and the minimum disturbed energy e quivalence surface is established, which can be used to determine the potential sliding surface.

该方法不仅从能量的观点给出了基于增稳内能与失稳外能比值的稳定安全系数，还将干扰能量法与等值面法结合起来，建立了用最小干扰能量等值面来确定潜在滑动面的方法。

On the basis of a great deal of information, several general problem on land sarface process parametrization for a global circulation model and its history of development are described. The Bucket model, EARTH, ISBA and SiSPAT models are respectively expounded, and the situation of studies on land surface process parametrization is summarized. China is a participating country of the international geosphere-biosphere program and the study on circulation of global energy and moisture, and has put forward some valuable soil-vegetation-atmosphere models for land surface process parametrization. which results in effective studies on vegetation indexes.

在大量资料基础上，叙述了大气环流模式陆面过程参数化方案的一般问题及其发展历程，分别阐述了水桶模式、EARTH模式、ISBA模式和SiSPAT模式；总结了在陆面过程参数化方面的研究状况，我国参与了国际地圈生物圈计划和全球能量与水分循环的研究，特别是在陆面过程的参数化研究方面，提出了一些有价值的土壤—植物—大气模式，对植被指数进行了有成效的研究。

Base on the design of the current laser energy meter, laser materials with better transparence, thicker absorbing layer and thermal sensitivity surface unsusceptible to damage were chosen, the temperature sensor and the digital processing circuit in the energy meter were redesigned to meet the requirements of laser energy metrology in field.

在现有激光能量计的基础上，通过选择相对透明、吸收层相对较厚、热敏面不易损伤的激光吸收材料，对激光能量计内置温度传感器及数字处理电路进行了重新设计，满足了不同温度条件下现场能量测量的需求。

As such, an intermediating factor, Relationship Quality is adopted and applied in this causal model. The top 500 companies from service industry and top 100 companies from financial industry are included in the questionnaire survey. The CRM climate is defined as the status of organizational CRM implementation and measured by the organizational management mechanism/HRM, the use of IT tools, the application domain of IT/IS. The relationship quality is measured by trust, interdependency, commitment, and conflict.

本研究以天下杂志公布之二OOO年服务业前五百大与金融业前一百大为研究对象，以问卷调查之方式探讨CRM气候、关系品质与组织绩效三者间之关系；其中，CRM气候为企业顾客关系管理执行之情况，并以组织制度与人事、资讯科技工具、资讯应用三构面来衡量；而关系品质构面则包括信任、相依度、承诺与冲突；最后，在组织绩效之衡量方面，涵括策略性组织绩效、服务流程、服务能量与员工四个构面。

Multiple-paths hydrogen abstraction reactions of fluorine -with CH_3OH have been investigated at the MP2/6-311 ++ g level. The potential energy surfaces for H-abstraction reaction from carbon atom and oxygen atom were given respectively. The results indicate that there is only one minimum energy path for hydrogen abstraction from carbon atom, while multiple paths were found for hydrogen abstraction from oxygen atom. All the stationary structures, frequencies as well as PES sketch of all channels were given, in which the dominant channel is by a five-member ring transition state. The calculated heat of reaction is 170.62 kj/mol for channel 1, 119.41 kJ/ mol for branch channel 6. The results are in good agreement with experimental data.

以MP2/6-311 ++g水平上详细研究了氟原子与甲醇抽氢反应的多通道反应机理，得到了各条通道中涉及的驻点的构型和振动频率及其能量，给出了两张完整的反应势能面，结果表明，氟原子从C原子上抽氢时有一条明显的最低能量通道，而从氧原子上抽氢时要涉及多条分支通道和多个驻点构型，给出了各分支通道势能面示意图，结果表明以形成五元环状过渡态通道为优势通道，计算得到经途径1生成CH_2OH时反应放热170.62kJ/mol，经分支途径6生成CH_3O自由基时反应放热119.4 kJ/mol，此结果与实验值一致。

According to the clear water experiment, aeration performance of the new equipment is good with high total oxygen transfer coefficient and oxygen utilization ratio.

曝气设备的动力效率在叶轮转速为120rpm～150rpm时取得最大值，此时氧利用率和充氧能力也具有较高值。

The environmental stability of that world - including its crushing pressures and icy darkness - means that some of its most famous inhabitants have survived for eons as evolutionary throwbacks, their bodies undergoing little change.

稳定的海底环境─包括能把人压扁的压力和冰冷的黑暗─意谓海底某些最知名的栖居生物已以演化返祖的样态活了万世，形体几无变化。