化工学报2016,Vol.67Issue(1):89-96,8.DOI:10.11949/j.issn.0438-1157.20151403
气体在金属-有机骨架材料中的吸附分离:经典密度泛函理论的应用
Gas adsorption and separation in metal-organic framework: application of classical density functional theory
摘要
关键词
金属-有机骨架/经典密度泛函理论/吸附(作用)/统计热力学/气体Key words
metal-organic framework/classical density functional theory/adsorption/statistical thermodynamics/gas分类
化学化工引用本文复制引用
刘宇,赵双良,胡军,刘洪来..气体在金属-有机骨架材料中的吸附分离:经典密度泛函理论的应用[J].化工学报,2016,67(1):89-96,8.基金项目
国家自然科学基金项目(91334203,21506051,21176066) (91334203,21506051,21176066)
上海市浦江人才计划(15PJ1401400) (15PJ1401400)
中央高校基本科研业务费(222201414008) (222201414008)
化学工程联合国家重点实验室开放课题(SKL-ChE-15C05).supported by the National Natural Science Foundation of China (91334203,21506051,21176066),the Shanghai Pujiang Program (15PJ1401400),the Fundamental Research Funds for the Central Universities of China (222201414008) and the Open Project of State Key Laboratory of Chemical Engineering (SKL-ChE-15C05). (SKL-ChE-15C05)