摘要
探讨了量子化学在水泥化学领域应用研究的基本思想,对近几年来应用量子化学SCCDVXα计算方法研究一些水泥熟料矿物价键结构与水化活性、水化产物相的力学强度和稳定性等问题所得到的结果进行了综述与评价。
It has been explored why quantum chemistry is applied to the research field of cement
chemistry. The results obtained by SCC DV X α computational method of quantum
chemistry in recent years of valence bond structures and hydration activity of some cement
clinker minerals, mechanical strength and stabilization of some hydrates were summarized and
evaluated. The prospects of the application of quantum chemistry to cement chemistry were
depicted.
出处
《建筑材料学报》
EI
CAS
CSCD
1999年第2期147-152,共6页
Journal of Building Materials
关键词
量子化学
SCC-DV-Xa算法
水泥
水化性能
quantum chemistry
SCC DV X α computational method
cement
calculated results
hydration properties