查询词典 atom model

In this thesis, the contribution of electric quadrupole (E2) and higher pole transitions to the opacity of hot and dense plasmas of element aurum is taken into account by using an average-atom model.

因此本文在有心力场单电子近似下，利用平均原子模型研究了电四极及更高阶跃迁对金元素的高温稠密等离子体辐射不透明度的贡献。

Describe the pollution simulation model; propose the decomposition principle which is independence between atom model and application, convenience of dynamic composition according to structure of pollution spreading simulation service. The basic idea is that decompensate the entire model, package the every sub model into grid service and deploy it into grid node.

从海上溢漏污染扩散模拟模型体系的构成出发，首先进行污染模拟模型的描述，提出了基本原子模型与实际应用的无关性、动态组合的方便性的模型体系分解原则，以及具体实现的思路；将整个海上溢漏污染扩散模拟模型体系进行分解，进行网格化封装与部署，形成独立的网格服务。

In order to know more about the microcosmic structure of the important biochemical model molecule formamide in aqueous solution, the Optimized Potentials for Liquid Simulations-All Atom model were used in the molecular dynamics simulation for the aqueous solution of FM in the whole concentration range. The radial distribution functions of the solutions were obtained. The interaction between water molecule and FM molecule was analyzed and calculated.

为了解重要的生化模型甲酰胺在水溶液中的微观结构，采用全原子力场在全浓度范围内对甲酰胺溶液进行了分子动力学模拟，得到了溶液的径向分布函数，分析计算了溶质和溶剂分子间的相互作用，对甲酰胺和水分子的氢键缔合情况进行了分析。

The valence electron structures of above cells were calculated based on the average atom model.

运用平均原子模型计算了这些晶胞的价电子结构。

The order-disorder transitions of stoichiometrical AB and A3B alloys werestudied by using effective-atom model based on EAM potential.The results give the analytic function form of the free energy in term of the long rangeorder parameter,and indicate that order-disorder transition behaviors of stoichiometri-cal AB and A3B alloys may be different. This method can be applied to interpret theexperimental results of order-disorder transition in stoichiometrical NiAl and Ni3Al.

利用EAM势基础上的等效原子模型分析了结构稳定性与长程有序度的关系，给出了二元体系结合能与长程有序度解析关系的一般表达式，说明当量成分下AB和A3B型合金有序无序转变行为的不同，并以NiAl和Ni3Al为研究对象具体研究了其有序无序转变，从理论上解释了这两种有序金属间化合物在实验中所表现出的不同有序无序转变行为特征。

Under the condition of Lit approximation and based on the average atom model proposed by R.

在物质处于局域热力学平衡的条件下，采用R。

Second step, in atom model foundation, utilization modelling tool establishment service model.

第二步，在元模型的基础上，运用建模工具建立业务模型。

In this thesis, the effect of vacancy concentration on elastic properties of aluminum under high pressures (from–15 GPa to 20 GPa) is studied by means of MD simulation. The embedded-atom model is employed to describe inter-atomic interaction in face-centered cubic aluminum.

本论文运用分子动力学方法，采用嵌入原子模型描述原子之间的相互作用势，在0-15GPa压强范围，对面心立方结构金属铝中空位密度对其弹性性质的影响进行了计算模拟。

In classicaIn classical hydrogen atom model an electron is circling around the nucleus like Earth revolving around the sun, except that the force between the l hydrogen atom model an electron is circling around the nucleus like Earth revolving around the sun, except that the force between the two electron

在经典的氢原子模型里，电子绕着原子核作圆周运动，在经典的氢原子模型里，电子绕著原子核作圆周运动，就象地球绕太阳运动一样就就像像地球绕太阳运动一样地球绕太阳运动一样，，只只是前者的是前者的而其引力来自电场。

In this paper we propose a one-dimensional muonic atom model, on which the time-dependent Schrdinger equation is numerically solved by Crank-Nicholson method.

本文提出了一个一维μ介子原子模型，用数值积分方法求解了在超强激光场作用下该模型原子的含时Schrdinger方程，得到了它的高次谐波发射谱。

On the other hand, the more important thing is because the urban housing is a kind of heterogeneity products.

另一方面，更重要的是由于城市住房是一种异质性产品。

Climate histogram is the fall that collects place measure calm value, cent serves as cross axle for a few equal interval, the area that the frequency that the value appears according to place is accumulated and becomes will be determined inside each interval, discharge the graph that rise with post, also be called histogram.

气候直方图是将所收集的降水量测定值，分为几个相等的区间作为横轴，并将各区间内所测定值依所出现的次数累积而成的面积，用柱子排起来的图形，也叫做柱状图。