机译:第一个原理研究CO2与Cu(苯-1,3,5-三羧酸盐)金属有机骨架表面的相互作用
Drexel Univ, Dept Mat Sci & Engn, Philadelphia, PA 19104 USA;
Chinese Acad Sci, Shanghai Adv Res Inst, CAS Key Lab Low Carbon Convers Sci & Engn, Shanghai 201210, Peoples R China;
Drexel Univ, Dept Chem, Philadelphia, PA 19104 USA;
Chinese Acad Sci, Shanghai Adv Res Inst, CAS Key Lab Low Carbon Convers Sci & Engn, Shanghai 201210, Peoples R China;
Chinese Acad Sci, Shanghai Adv Res Inst, CAS Key Lab Low Carbon Convers Sci & Engn, Shanghai 201210, Peoples R China;
Chinese Acad Sci, Shanghai Adv Res Inst, CAS Key Lab Low Carbon Convers Sci & Engn, Shanghai 201210, Peoples R China|Drexel Univ, Dept Chem, Philadelphia, PA 19104 USA;
Drexel Univ, Dept Mat Sci & Engn, Philadelphia, PA 19104 USA|Drexel Univ, Dept Chem, Philadelphia, PA 19104 USA;
Density functional theory; Modelling; Isotherm; Metal organic framework; Surface adsorption;
机译:Cu_2,1,3,5-三羧酸铜(Cu-BTC)金属有机骨架吸附CO_2的实验和数值研究
机译:HKUST(铜,1,3,5-三羧酸铜,Cu-BTC MOF)-1金属有机骨架对CH_4吸附的研究:GCMC(大经典蒙特卡洛)模拟的实验研究
机译:由1,2-双(1,2,4-三唑-4-基)乙烷构成的Cu(II),Cu(II)_4O_4核和Cd(II)混合配体金属有机骨架的磁性和发光性质和1,3,5-三羧酸苯
机译:与三羧酸苯连接的金属有机骨架的基于功函数的气体传感—比较研究
机译:金属有机框架中气体吸附的第一原理研究。
机译:方钠石型M-BTT(M = CrMnFeCu)金属-有机骨架中具有开放金属位点的CO2吸附的实验和计算研究
机译:铜(II)-1,3,5-三羧酸铜金属有机骨架(Cu-BTC)化合物的参考衍射图,微观结构和孔径分布