To get more accurate kinetic data of the absorption of CO2 into aqueous solution of N-methyldiethanolamine,a wetted wall column was modified to more uniformly distribute the liquid on the column surface and gas in the...To get more accurate kinetic data of the absorption of CO2 into aqueous solution of N-methyldiethanolamine,a wetted wall column was modified to more uniformly distribute the liquid on the column surface and gas in the absorbing chamber and change the length of the column.The average liquid film thickness and the liquid-phase mass transfer coefficient were measured,and a correlation for the Sherwood number,Reynolds number and Schmidt number was obtained for the modified wetted wall column.The equilibrium concentrations in chemical reactions were calculated with a minor absolute error for calculating the rate constant more accurately.A mathe-matical model for the CO2 absorption was established based on the diffusional mass transfer accompanied with parallel reversible reactions,and the partial differential equation was solved by Laplace transform.An analytical ex-pression for the concentration of carbon dioxide as a function of time and penetration depth in liquid film and the average interphase mass transfer rate was obtained.This model was also used to calculate the rate constant for a second-order reaction,which was in good agreement with reported data.展开更多
The decay dynamics of N, N-dimethylthioacetamide after excitation to the S3（ππ＊） state was studied by using the resonance Raman spectroscopy and complete active space self- consistent field method calculations. T...The decay dynamics of N, N-dimethylthioacetamide after excitation to the S3（ππ＊） state was studied by using the resonance Raman spectroscopy and complete active space self- consistent field method calculations. The UV-absorption and vibrational spectra were as- signed. The A-band resonance Raman spectra were obtained in acetonitrile, methanol and water with the laser excitation wavelengths in resonance with the first intense absorption band to probe the Franck-Condon region structural dynamics. The CASSCF calculations were carried out to determine the excitation energies and optimized structures of the lower- lying singlet states and conical intersection point. The A-band structural dynamics and the corresponding decay mechanism were obtained by the analysis of the resonance Raman in- tensity pattern and the CASSCF calculated structural parameters. The major decay channel of S3,FC （ππ＊）→S3（ππ＊）/S1 （nπ＊）→S1（nπ＊） is proposed.展开更多
In order to study the electrodeposition process of iridium in composite ionic liquid, the effects of N, N-dimethylacetamide（DMAC） on the viscosity, conductivity and electrochemical stability of composite ionic liqui...In order to study the electrodeposition process of iridium in composite ionic liquid, the effects of N, N-dimethylacetamide（DMAC） on the viscosity, conductivity and electrochemical stability of composite ionic liquid BMIC-BMIBF4, as well as the electrochemical behavior of Ir Cl3 in this system were studied. Iridium（Ir） coatings were deposited at different constant potentials and characterized by SEM and XRD. The results show that the addition of DMAC can evidently decrease the viscosity of the composite system, increase conductivity and improve electrochemical stability of the composite system. Cyclic voltammograms of a Au electrode illustrate that the process controlled by diffusion rate is irreversible with the average charge transfer coefficient of 0.170 and average diffusion coefficient of 1.096×10-6 cm^2/s. In addition, SEM image shows that Ir film deposited at the reduction peak potential is dense and even, while XRD pattern shows that Ir deposit is polycrystalline structure.展开更多
Terephthalic acid(PTA) is practically one of the main materials of polyester. Its corresponding solid-liquid equilibrium data will provide essential support for industry design and further theoretical studies. In this...Terephthalic acid(PTA) is practically one of the main materials of polyester. Its corresponding solid-liquid equilibrium data will provide essential support for industry design and further theoretical studies. In this work,solid-liquid equilibriums of terephthalic acid in four solvents, N,N-dimethylformamide, N,N-dimethylacetamide,dimethylsulphoxide and N-methyl-2-ketopyrrolidene, were determined in the temperature range from 293.15 K to 364.6 K by dynamic method. All these data were regressed by λh model, Wilson model and NRTL model, average absolute relative deviations of which are 1.25%, 15.02% and 7.22% respectively. It indicates that λh model is mostsuitable for description of the solid-liquid equilibrium containing PTA.展开更多
基金Supported by China Petroleum&Chemical Corporation(105044)
文摘To get more accurate kinetic data of the absorption of CO2 into aqueous solution of N-methyldiethanolamine,a wetted wall column was modified to more uniformly distribute the liquid on the column surface and gas in the absorbing chamber and change the length of the column.The average liquid film thickness and the liquid-phase mass transfer coefficient were measured,and a correlation for the Sherwood number,Reynolds number and Schmidt number was obtained for the modified wetted wall column.The equilibrium concentrations in chemical reactions were calculated with a minor absolute error for calculating the rate constant more accurately.A mathe-matical model for the CO2 absorption was established based on the diffusional mass transfer accompanied with parallel reversible reactions,and the partial differential equation was solved by Laplace transform.An analytical ex-pression for the concentration of carbon dioxide as a function of time and penetration depth in liquid film and the average interphase mass transfer rate was obtained.This model was also used to calculate the rate constant for a second-order reaction,which was in good agreement with reported data.
基金This work was supported by the National Natu- ral Science Foundation of China （No.21033002 and No.21202032） and the National Basic Research Pro- gram of China （No.2013CB834604）.
文摘The decay dynamics of N, N-dimethylthioacetamide after excitation to the S3（ππ＊） state was studied by using the resonance Raman spectroscopy and complete active space self- consistent field method calculations. The UV-absorption and vibrational spectra were as- signed. The A-band resonance Raman spectra were obtained in acetonitrile, methanol and water with the laser excitation wavelengths in resonance with the first intense absorption band to probe the Franck-Condon region structural dynamics. The CASSCF calculations were carried out to determine the excitation energies and optimized structures of the lower- lying singlet states and conical intersection point. The A-band structural dynamics and the corresponding decay mechanism were obtained by the analysis of the resonance Raman in- tensity pattern and the CASSCF calculated structural parameters. The major decay channel of S3,FC （ππ＊）→S3（ππ＊）/S1 （nπ＊）→S1（nπ＊） is proposed.
基金Project(51071014)supported by the National Natural Science Foundation of ChinaProject(2010ZE51055)supported by the Aviation Science Foundation of China
文摘In order to study the electrodeposition process of iridium in composite ionic liquid, the effects of N, N-dimethylacetamide（DMAC） on the viscosity, conductivity and electrochemical stability of composite ionic liquid BMIC-BMIBF4, as well as the electrochemical behavior of Ir Cl3 in this system were studied. Iridium（Ir） coatings were deposited at different constant potentials and characterized by SEM and XRD. The results show that the addition of DMAC can evidently decrease the viscosity of the composite system, increase conductivity and improve electrochemical stability of the composite system. Cyclic voltammograms of a Au electrode illustrate that the process controlled by diffusion rate is irreversible with the average charge transfer coefficient of 0.170 and average diffusion coefficient of 1.096×10-6 cm^2/s. In addition, SEM image shows that Ir film deposited at the reduction peak potential is dense and even, while XRD pattern shows that Ir deposit is polycrystalline structure.
基金Supported by China Petroleum & Chemical Corporation(No.200049).
文摘Terephthalic acid(PTA) is practically one of the main materials of polyester. Its corresponding solid-liquid equilibrium data will provide essential support for industry design and further theoretical studies. In this work,solid-liquid equilibriums of terephthalic acid in four solvents, N,N-dimethylformamide, N,N-dimethylacetamide,dimethylsulphoxide and N-methyl-2-ketopyrrolidene, were determined in the temperature range from 293.15 K to 364.6 K by dynamic method. All these data were regressed by λh model, Wilson model and NRTL model, average absolute relative deviations of which are 1.25%, 15.02% and 7.22% respectively. It indicates that λh model is mostsuitable for description of the solid-liquid equilibrium containing PTA.
