Prediction of thermodynamic properties of actinide and lanthanide compounds

被引:0
|
作者
LU Chunhai1
机构
关键词
QSPR; Actinide; Lanthanide; Compound; Thermodynamics property;
D O I
暂无
中图分类号
O614.33 [镧系元素(稀土元素)];
学科分类号
070301 ; 081704 ;
摘要
Several relationship models for thermodynamic functions of actinide and lanthanide compounds are built. The descriptors such as the difference of atomic radii between metal atoms and nonmetal atoms and the molecular mass are used in quantitative structure-activity/property relationships. The relative errors for entropy and heat capacity are less than 20% in the majority of gaseous compounds. Similar results are obtained from solid compounds.
引用
收藏
页码:152 / 158
页数:7
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