Studies on the full vibrational energy spectra and potential energy curves for ground state of fluorine hydrogen HF and its cation HF+;
氟化氢分子HF及其离子HF~+基态电子态的完全振动能谱和势能曲线的精确研究
The interaction potential energy curves of Li+ and HC2n-have also been calculated.
应用密度泛函理论(DFT)和多体微扰理论(MP2),对Li+与线性碳链HC2n-形成的体系HC2nLi(n=1~8,C∞v)的平衡几何构型、谐振动频率、第一绝热电离能和结合能进行了研究并计算了HC2n-与Li+之间相互作用的势能曲线。
The different geometrical structures and potential energy curves of the molecule PuH_3 are calculated with the discrete variational method(DVM),which is based upon the density functional theory.
基于密度泛函理论的全数值自洽场计算方法———离散变分方法(DVM),数值解相对论Dirac方程,在自由的钚原子和氢原子波函数的数值基及原子能级基础上计算了PuH3分子的不同几何结构及势能曲线。
The calculated results of thepotential well parameters and the potential curve are in 8ood agreement with published experimentedda
势阶参数和势能曲线的计算结果与实验数据较好地符合。
The QCISD(T) and QCISD method is applied to scan the potential curves for X~2Πstates of SH(D) and OH(D) molecule with 6-311++G(3df,2pd) basis set,respectiv
本文前几部分在简单介绍与分子势能函数研究相关基础理论知识和计算方法的基础上,通过计算、分析比较,在n=3的Murrell-Sorbie解析势能函数的基础上,首次得到了能够正确描述双原子分子特殊势能曲线的n=9的Murrell-Sorbie解析势能函数。
non crossing rule of potential curve
势能曲线不交叉规则
This potential curve crosses a potential curve α'.
这条势能曲线和另一条势能曲线α′相交。
Study of the Potential Energy Curve and Spectrum of the Kr-Xe Dimer
Kr-Xe体系势能曲线和光谱研究
Theoretic Studies on the Potential Energy Curves of Some Hydride Diatomic Molecules;
氢化物双原子分子势能曲线的理论研究
Study of Structure and Potential Energy Curve for Ground State of ScF;
ScF分子结构、(X~1∑~+)态势能曲线和光谱常数研究
Calculation of Potential Energy Curves of S_2~+ Molecular Ion and the Assignment of S_2 Photoelectronic Spectra;
S_2~+分子离子的势能曲线计算与S_2分子光电谱的指认
MRCI Potential Curves and Analytical Potential Energy Functions of the Group ⅡB Metal Dimers;
多参考组态方法研究第二副族金属二聚体的势能曲线和解析势能函数
The path of an arrow is a curve.
箭的走势是一条曲线。
a trend derived from or as if from such a graph.
从曲线图上或似乎从曲线图上呈现出的趋势.
The index tendency of Shenzhen and Shanghai stock market predicts the curve graph in 2001
2001年深沪两市指数走势预测曲线图
Graham-Schaefer equilibrium production curve
格雷厄姆-谢弗均势产量曲线
characteristic curve of pump
水泵性能（特性）曲线
Research on bending of the cantilever based on the principle of minimum potential energy
基于最小势能原理的悬臂梁弯曲研究
3-D Surface. Shows trends in values across two dimensions in a continuous curve.
三维曲面图。在连续曲面上跨两维显示数值的趋势线
The curve in Fig. 35-6(b)shows the regions in which each process is dominant.
图35-6（b）中的曲线表明各个过程占优势的范围。
A Note on a Priori Estimate of Double Layer Potential for Boundary Curves
关于双层热势对边界曲线的先验估计的注记
Static Life Table and Survival Curve of Dominant Populations of Tianma Mountain in Xinyi;
信宜天马山优势种群的静态生命表及存活曲线
An Alternative Curve Analyzing Method of Stock;
关于股票价格走势的一种曲线分析新方法
