1.
Force Field Development and Predictions of Thermodynamic Properties for Aldehydes and Ketones
醛酮类化合物的分子力场参数推导及热力学性质计算
2.
Application of the Three-Parameter Corresponding State Principlein the Thermodynamic Function Calculation;
三参数对应状态原理在热力学性质计算方面的应用
3.
Calculation of Thermodynamic Properties of the Multicomponent Alloys with Miedema Theory;
合金热力学性质的Miedema理论计算
4.
Theoretical Calculation for Thermodynamics Properties of CuO_2 plane;
CuO_2平面热力学性质的理论计算
5.
Theoretical calculation of thermodynamic properties of polybrominated phenoxathiins
多溴代吩噁噻热力学性质的理论计算
6.
The Study about the Thermodynamic Properties of Hadronic Matter and the Non-perturbative CJT Method;
强子物质热力学性质和非微扰CJT计算方法研究
7.
Research on the Mechanics Properties and Thermal Strain of Function Gradient Material;
功能梯度材料力学性质和热应力计算研究
8.
First-principles Calculation for the Structural and Thermodynamic Properties of ReB_2
ReB_2的结构和热力学性质的第一性原理计算
9.
Theoretical Calculation of Potential Energy Functions and Thermodynamic Properties of the CeH Molecule
CeH分子势能函数与热力学性质的理论计算
10.
Calculation of Thermodynamic and Thermophysical Properties of Working Substance in Liquid Stirling Engine
液相斯特林机工质的热力学与热物理性质的计算
11.
Fast Calculation Model of Thermodynamic and Transport Properties of R22 in Superheat Region
过热区R22热力性质及传输特性的快速计算模型
12.
First-principles Calculations for the Structure and Thermodynamic Properties of ZrB_2 Compound under High Pressure
高压下ZrB_2的结构和热力学性质的第一性原理计算
13.
CALCULATIONS OF VIBRATIONAL SPECTRA AND THERMAL PROPERTIES OF METHANE SERIES BY DENSITY FUNCTIONAL THEORY(DFT)
密度泛函理论计算氘代甲烷振动频率和热力学性质
14.
Calculation of the Thermodynamic Properties of Fluids by Using the First-Order Mean Spherical Approximation Equation of State;
由一阶平均球形近似状态方程计算流体的热力学性质
15.
Molecular-Dynamics Simulation Study on the Thermodynamics Properties of Au, Ag and Their Alloy Nanoclusters;
金、银及其合金纳米团簇热力学性质的计算机模拟研究
16.
Modeling of Aqueous Electrolyte Solution by Statistical Mechanic Theory;
用统计力学理论研究电解质溶液的热力学性质
17.
The Comparison of Characteristics of Thermal Performance and Optimization and Simulation Calculation Method of Several New Refrigerant
新型制冷剂热力性质的快速计算及其特性研究
18.
Thermodynamics Calculation and Structure Properties Research of Heat-Resistant Steel GX12
GX12耐热铸钢热力学计算分析及组织性能研究