查询词典 automatic calculation

In this paper, high-level quantum chemistry calculation methods are used to theoretically investigate basic configuration, conformers, torsion potential energy surface and internal rotation transition state of oxalic acid and oxalyl halides.

第三章采用量子化学的MP2、B3LYP、HF计算方法在6-311++G~水平上，对草酸可能存在的十三种构型进行完全放开的全几何优化及振动频率分析，得到八种稳定构型和五种内转动过渡态构型。

According to the character and advantage of partitional modeling, we construct the SD model of anaerobic reactor which is fed by glucose, and used a different calculation way for different blocks. Comparing with the lab data, errors between SD model, test data, and Andrews' model is less than 10%.

根据分块建模的优势及特点，对模型中的3个子系统采用不同的计算方式，通过对比模拟结果表明，SD模型静态模拟结果与实验数据、传统结构模型模拟结果之间的误差0%，动态模拟结果与实际趋势一致，说明SD模型的模拟结果是可信的。

By simulation and optimization calculation Using the model, the secondary cooling system and the control patte...

应用该模型进行仿真和优化计算，获得了适应涟钢铸机生产特点的高效连铸二冷制度及二冷控制方式。

Based on the prefector's motion mode on the press , the method of twice converted system is used to analyze the moving characteristics of the upper and lower grippers of perfector, and through practical calculation, this method can prove to be applicable to perfector movement research.

从印刷机纸张翻转机构的运动方式出发，利用二次转化系统的方法分析了翻转机构上下牙片的运动特性，并通过实例计算证明了本方法适用于翻转机构的运动研究，对印刷机翻转机构的设计工作具有指导意

For the application of 64 Codons, each step from DNA chain to mRNA chain, t RNA, ribosome, peptides, and to protein, has its specific permutable calculation model between chemical reactants and products, none of which has an objective permutable relationship with that in the 43 Table of Triplet Codes.

在生物遗传学的解释上，不预先测定给定生命体的 DNA 碱基顺序及其蛋白质的氨基酸顺序并把两者作比较，就把 DNA 和密码表两者指导合成的多肽链的氨基酸顺序称为该生命体遗传得来的氨基酸顺序，并以此将密码表称为生命的元素周期律在一切生命体中通用，是完全错误的。

To avoid the permutable model of protein, the 43 Table of Triplet Codes Given by F.H.C.Crick in 1969 is in fact that one group of permutations versus the permutation elements in another group of permutations , which is a typical wrong application and a wrong calculation.

Crick 43 遗传密码表回避蛋白质分子的排列组合模型问题，根据氨基酸种类数20 和 DNA 上碱基种类数 4进行对四元素选三元素的排列组合计算建立& DNA ～蛋白质&间的一一对应，本质上是排列组合应用中一组排列组合对应另一组排列组合的具体元素。

The application of the genetic codes is another kind of permutable calculation . From DNA chain to mRNA chain , t RNA , ribosome , peptides

密码表应用体系中，从DNA分子到m RNA分子到t RNA，再到核糖体到肽链，没有一步使用了排列数计算方法，从而造成DNA分子信息传递时步步失真，最后变成了肽链具体位置上的氨基酸分子，这里的每一步信息传递都是对密码表的错误运用。

In the framework of Feynman diagram calculation, two pieces of work were accomplished with thestandard application of perturbative manipulation of radiative corrections.

最小超对称标准模型，是粒子物理标准模型之外的新物理的最有希望的理论之一。为检验这种模型，有必要进行一些高阶的微扰论计算。

The scale inhibition mechanism of PESA was proposed on the basis of characterization of transformation of calcium carbonate crystal by means of X-ray Diffraction and scanning electron microscopy. The effect of temperature on corrosion inhibition efficiency of PESA was investigated and the Bockris substitution model is proposed to study the thermodynamics of inhibiting process of PESA. The calculation results show the adsorption of PESA on carbon steel is a spontaneous exothermic process with the increase of entropy.

通过X射线衍射和扫描电镜分析手段研究了聚环氧琥珀酸加入前后碳酸钙垢晶型的变化，在此基础上探讨了聚环氧琥珀酸的阻垢机理；考察了温度对聚环氧琥珀酸缓蚀性能的影响，根据Bockris置换模型，计算出中性水质中聚环氧琥珀酸在碳钢表面吸附的热力学函数，计算结果表明：聚环氧琥珀酸在碳钢表面的吸附是一个放热、熵增、自动发生的过程。

A detailed petrologic and mineralogic study and a forming condition calculation have been carried out on the two types of enclaves.

对这两类岩石包体进行了详细的岩石学和矿物学研究，并计算了各类岩石包体的形成条件。

We are in a good position to meet your requirements.

我们完全可以满足你方的需求。

We are all pervade d with a sense of disaster.

我们普遍有大祸降临的感觉。