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Molecular Dynamics Studies on Thermal Behavior of a FAU-type Zeolite
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作者 Ting Jun HOU Ming Juan JI +4 位作者 Hui liu Xiao Wei Huang Xue Qi Ye xing yun liu Xiao Jie XU (Chemistry Department. Beida-Jiuyuan Molecular Design Laboratory. Peking University. Beijing 100871)(Graduate School of Chinese Academy of Sciences. Beiing 100039) 《Chinese Chemical Letters》 SCIE CAS CSCD 1999年第6期515-518,共4页
Molecular Dynamics (MD) simulations of siliceous FAU-type zeolite were carried out at various temperatures. to investigate its thermal behaviors. From the study. we found that pure silicon fanjasite showed different t... Molecular Dynamics (MD) simulations of siliceous FAU-type zeolite were carried out at various temperatures. to investigate its thermal behaviors. From the study. we found that pure silicon fanjasite showed different thermal behaviors below 1500K and above 1500K. its cell volume gradually shrinks with the rising of the temperature below 1500K. the cell volume of the zeolite changes little above 1500K. 展开更多
关键词 ZEOLITE molecular dynamics(MD) thermal behavior
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Mechanism of Dealumination of NaY Zeolite with Oxalic Acid
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作者 Hui liu xing yun liu +1 位作者 Xuan Wen LI Xiao Jie XU(College of Chemistry and Molecular Engineering, Peking University, Beijing 100871) 《Chinese Chemical Letters》 SCIE CAS CSCD 1998年第8期789-790,共2页
Dealuminated Y zeolite with high crystallinity is obtained from NaY zeolite by treatment with oxalic acid in a buffering system. The effect of dealumination conditions on the degree of dealumination and the crystallin... Dealuminated Y zeolite with high crystallinity is obtained from NaY zeolite by treatment with oxalic acid in a buffering system. The effect of dealumination conditions on the degree of dealumination and the crystallinity of the reformed zeolite is discussed. A mechanism for the reaction is proposed. 展开更多
关键词 NaY zeolite oxalic acid dealumination mechanism
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