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分子动力学模拟甲烷水合物结构稳定性
万丽华1; 颜克凤1; 鲁涛1; 李小森1; 樊栓狮2
2010
Source Publication武汉理工大学学报
ISSN1671-4431
Volume000Issue:002Pages:25
Abstract采用经典的NVT系综分子动力学方法模拟研究在不同温度下晶穴占有率对甲烷水合物晶体结构稳定性的影响。模拟显示高晶穴占有率和低温均有利于甲烷水合物晶体结构的稳定。在NVT系综模拟条件下,当晶穴占有率θ=100%甲烷水合物晶体可以在较高的温度下稳定存在 当θ〉37.5%,在适宜的温度下可以稳定存在 较低的温度可使空甲烷水合物笼形结构稳定。
Language英语
Document Type期刊论文
Identifierhttp://ir.giec.ac.cn/handle/344007/19196
Collection中国科学院广州能源研究所
Affiliation1.中国科学院广州能源研究所
2.华南理工大学
First Author AffilicationGuangZhou Institute of Energy Conversion,Chinese Academy of Sciences
Recommended Citation
GB/T 7714
万丽华,颜克凤,鲁涛,等. 分子动力学模拟甲烷水合物结构稳定性[J]. 武汉理工大学学报,2010,000(002):25.
APA 万丽华,颜克凤,鲁涛,李小森,&樊栓狮.(2010).分子动力学模拟甲烷水合物结构稳定性.武汉理工大学学报,000(002),25.
MLA 万丽华,et al."分子动力学模拟甲烷水合物结构稳定性".武汉理工大学学报 000.002(2010):25.
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