A series of Ni-Mo/zeolite-Al2o3 catalysts was prepared by incipient wetness impregnation and their catalytic experiments were carried out using an automated microflow apparatus.It is concluded that the Ni-Mo catalyst ...A series of Ni-Mo/zeolite-Al2o3 catalysts was prepared by incipient wetness impregnation and their catalytic experiments were carried out using an automated microflow apparatus.It is concluded that the Ni-Mo catalyst loaded on the HUSY has larger BET surface areas and possesses more acid sites than that loaded on the HY zeolite,and simultaneously the Ni-Mo/HUSY-Al2O3 catalyst reveals higher catalytic activ-ity characterized by feedstock conversion and isomer yield which is about two or three times higher than that of the Ni-Mo/HY-Al2O3 catalyst.展开更多
Methanol adsorption in zeolite and phosphorus modified zeolite has been investigated within the-cluster model framework of quantum chemical calculation. Full optimization and frequency analysis of all cluster model ha...Methanol adsorption in zeolite and phosphorus modified zeolite has been investigated within the-cluster model framework of quantum chemical calculation. Full optimization and frequency analysis of all cluster model have been carried out using Gaussian 94 soft package with Hartree-Fock method and B3LYP, B3P86 hybrid methods of density functional theory at 3-21G, 6-31G basis set level for hydrogen atoms and 6-31G+(d) basis set level for the other atoms performed on small cluster model for CH3OH, H3Al(OH)SiH2(H2PO4), H3Al(OH)SiH2(H3SiO4), H3Al(OH-CH3OH)SiH2(H2PO4) and H3A1(OH-CH3OH)SiH2(H3SiO4). The results show that phosphorus grafting in the zeolite framework has modified the chemical environment in the vicinity of the zeolite bridging hydroxyl. Phosphorus modification can enhance the acid strength of zeolite bridging hydroxyl, which was suggested by the lengthening of zeolite bridging hydroxyl O-H bond and the increasing methanol adsorption energy. This may be favorable to the initial CH3 OCH3 formation in the methanol to gasoline (MTG) process.展开更多
The catalytic activity of trimethyl phosphite modified HZSM-5 zeolite and un-modified HZSM-5zeolite treated with 100% steam at 673,773,873,973 and 1073K, respectively, were investigated using heptanecracking as a prob...The catalytic activity of trimethyl phosphite modified HZSM-5 zeolite and un-modified HZSM-5zeolite treated with 100% steam at 673,773,873,973 and 1073K, respectively, were investigated using heptanecracking as a probe reaction. The results showed that the heptane conversion of both trimethyl phosphitetreated samples and un-phosphated samples decreased with an increase in treating temperature, but trimethylphosphite modified samples showed higher activity in comparison with the un-modified samples, which weresteam-treated at a higher temperature. The results were firstly elucidated by the model cluster method andcomputational quantum chemistry method. Full optimization and frequency analysis of all cluster model havebeen carried out using the Gaussian 94 software-package with the PM 3 semi-empirical method performed onsmall cluster models. The computational results showed that the dealumination of trimethyl phosphite modi-fied zeolite model cluster was more difficult than that of un-modified zeolite model cluster when they weretreated with steam while investigating the heat of reaction.展开更多
In this paper,the upper structural layer of the southern Yellow Sea Basin (SYSB) is further divided into three layers based on the latest obtained high-resolution single-channel seismic profiles.Combined with the bore...In this paper,the upper structural layer of the southern Yellow Sea Basin (SYSB) is further divided into three layers based on the latest obtained high-resolution single-channel seismic profiles.Combined with the borehole data,the characteristics and evolvement of structure and environment since middle-late Tertiary are discussed.The study shows that the acoustic-base indicated by shallow seismic profiles represents the basic shape of the SYSB in late Oligocene-early Miocene.Based on the comprehensive analysis of some typical profiles crossing the basin about seismostratigraphy,gravity and magnetics,the basin about seismostratigraphy,gravity and magnetics,the basin edge fault and some basin inner structure are identified.Furthermore,the acoustic-base is classified into four types of basal lithofacies:Eogene basin basement,Paleozoic basement,Mesozoic basement and magma intrusion basement.展开更多
文摘A series of Ni-Mo/zeolite-Al2o3 catalysts was prepared by incipient wetness impregnation and their catalytic experiments were carried out using an automated microflow apparatus.It is concluded that the Ni-Mo catalyst loaded on the HUSY has larger BET surface areas and possesses more acid sites than that loaded on the HY zeolite,and simultaneously the Ni-Mo/HUSY-Al2O3 catalyst reveals higher catalytic activ-ity characterized by feedstock conversion and isomer yield which is about two or three times higher than that of the Ni-Mo/HY-Al2O3 catalyst.
基金the Doctor’s Foundation of University of Petroleum
文摘Methanol adsorption in zeolite and phosphorus modified zeolite has been investigated within the-cluster model framework of quantum chemical calculation. Full optimization and frequency analysis of all cluster model have been carried out using Gaussian 94 soft package with Hartree-Fock method and B3LYP, B3P86 hybrid methods of density functional theory at 3-21G, 6-31G basis set level for hydrogen atoms and 6-31G+(d) basis set level for the other atoms performed on small cluster model for CH3OH, H3Al(OH)SiH2(H2PO4), H3Al(OH)SiH2(H3SiO4), H3Al(OH-CH3OH)SiH2(H2PO4) and H3A1(OH-CH3OH)SiH2(H3SiO4). The results show that phosphorus grafting in the zeolite framework has modified the chemical environment in the vicinity of the zeolite bridging hydroxyl. Phosphorus modification can enhance the acid strength of zeolite bridging hydroxyl, which was suggested by the lengthening of zeolite bridging hydroxyl O-H bond and the increasing methanol adsorption energy. This may be favorable to the initial CH3 OCH3 formation in the methanol to gasoline (MTG) process.
文摘The catalytic activity of trimethyl phosphite modified HZSM-5 zeolite and un-modified HZSM-5zeolite treated with 100% steam at 673,773,873,973 and 1073K, respectively, were investigated using heptanecracking as a probe reaction. The results showed that the heptane conversion of both trimethyl phosphitetreated samples and un-phosphated samples decreased with an increase in treating temperature, but trimethylphosphite modified samples showed higher activity in comparison with the un-modified samples, which weresteam-treated at a higher temperature. The results were firstly elucidated by the model cluster method andcomputational quantum chemistry method. Full optimization and frequency analysis of all cluster model havebeen carried out using the Gaussian 94 software-package with the PM 3 semi-empirical method performed onsmall cluster models. The computational results showed that the dealumination of trimethyl phosphite modi-fied zeolite model cluster was more difficult than that of un-modified zeolite model cluster when they weretreated with steam while investigating the heat of reaction.
文摘In this paper,the upper structural layer of the southern Yellow Sea Basin (SYSB) is further divided into three layers based on the latest obtained high-resolution single-channel seismic profiles.Combined with the borehole data,the characteristics and evolvement of structure and environment since middle-late Tertiary are discussed.The study shows that the acoustic-base indicated by shallow seismic profiles represents the basic shape of the SYSB in late Oligocene-early Miocene.Based on the comprehensive analysis of some typical profiles crossing the basin about seismostratigraphy,gravity and magnetics,the basin about seismostratigraphy,gravity and magnetics,the basin edge fault and some basin inner structure are identified.Furthermore,the acoustic-base is classified into four types of basal lithofacies:Eogene basin basement,Paleozoic basement,Mesozoic basement and magma intrusion basement.
