Firstly, sample square-circular transition tube along straight central route was modeled on CATIA software. The parameters are as follows： let the tube length is L, and the constant cross section area is S, and S = ...Firstly, sample square-circular transition tube along straight central route was modeled on CATIA software. The parameters are as follows： let the tube length is L, and the constant cross section area is S, and S = πR^2 = a2, in which R stands for the circle radius on one end, and a the square side length on the other end; set up the coordinate system with OX axis on the central route in which the origin O is on centroid of the square end and assume the cross section size at x as the square shaped with all four comers filleted in radius r which is proportional to x, that is, the linear slope of r is R/L, thus, both values r and square side length ax can be attained on the constant cross section area assumption. Secondly, some sample polygonal-circular transition tubes along straight, circular and helical central route were implemented similarly. Thirdly, numerical analysis of stress and displacement of these tubes were carried out on MSC/PATRAN software which are important to the distribution of turbulent flow and the layout of these transitional tube structures.展开更多
An alternative expression for photoionization cross-section of atoms or molecules and a dielectric influence function （DIF） in a high-density system proposed recently are used to study the photoionization cross-sect...An alternative expression for photoionization cross-section of atoms or molecules and a dielectric influence function （DIF） in a high-density system proposed recently are used to study the photoionization cross-sections of solid silver. It is suggested that a density turning point （DTP） of a photoionized system may be viewed as the critical point where the photoionization properties of atoms in a real system may have a notable change. The results show that the present theoretical photoionization cross-sections are in good agreement with the experimental results of a silver crystal both in structure and in magnitude.展开更多
A quasi-classical trajectory（QCT） calculation is used to investigate the vector and scalar properties of the D ＋ Br O → DBr ＋ O reaction based on an ab initio potential energy surface（X1A state） with collision ...A quasi-classical trajectory（QCT） calculation is used to investigate the vector and scalar properties of the D ＋ Br O → DBr ＋ O reaction based on an ab initio potential energy surface（X1A state） with collision energy ranging from 0.1 kcal/mol to 6 kcal/mol. The reaction probability, the cross section, and the rate constant are studied. The probability and the cross section show decreasing behaviors as the collision energy increases. The distribution of the rate constant indicates that the reaction favorably occurs in a relatively low-temperature region（T 〈 100 K）. Meanwhile, three product angular distributions P（θr）, P（φr）, and P（θr, φr） are presented, which reflect the positive effect on the rotational angular momentum j＇ polarization of the DBr product molecule. In addition, two of the polarization-dependent generalized differential cross sections（PDDCSs）, PDDCS00 and PDDCS20, are computed as well. Our results demonstrate that both vector and scalar properties have strong energy dependence.展开更多
文摘Firstly, sample square-circular transition tube along straight central route was modeled on CATIA software. The parameters are as follows： let the tube length is L, and the constant cross section area is S, and S = πR^2 = a2, in which R stands for the circle radius on one end, and a the square side length on the other end; set up the coordinate system with OX axis on the central route in which the origin O is on centroid of the square end and assume the cross section size at x as the square shaped with all four comers filleted in radius r which is proportional to x, that is, the linear slope of r is R/L, thus, both values r and square side length ax can be attained on the constant cross section area assumption. Secondly, some sample polygonal-circular transition tubes along straight, circular and helical central route were implemented similarly. Thirdly, numerical analysis of stress and displacement of these tubes were carried out on MSC/PATRAN software which are important to the distribution of turbulent flow and the layout of these transitional tube structures.
基金Project supported by the National Natural Science Foundation of China （Grant No 10474068） and the Natural Science Foundation of Yantai Normal University （Grant No 22270301）.
文摘An alternative expression for photoionization cross-section of atoms or molecules and a dielectric influence function （DIF） in a high-density system proposed recently are used to study the photoionization cross-sections of solid silver. It is suggested that a density turning point （DTP） of a photoionized system may be viewed as the critical point where the photoionization properties of atoms in a real system may have a notable change. The results show that the present theoretical photoionization cross-sections are in good agreement with the experimental results of a silver crystal both in structure and in magnitude.
基金supported by the Jilin University,China(Grant No.419080106440)the Chinese National Fusion Project for the International Thermonuclear Experimental Reactor(ITER)(Grant No.2010GB104003)the National Natural Science Foundation of China(Grant No.10974069)
文摘A quasi-classical trajectory（QCT） calculation is used to investigate the vector and scalar properties of the D ＋ Br O → DBr ＋ O reaction based on an ab initio potential energy surface（X1A state） with collision energy ranging from 0.1 kcal/mol to 6 kcal/mol. The reaction probability, the cross section, and the rate constant are studied. The probability and the cross section show decreasing behaviors as the collision energy increases. The distribution of the rate constant indicates that the reaction favorably occurs in a relatively low-temperature region（T 〈 100 K）. Meanwhile, three product angular distributions P（θr）, P（φr）, and P（θr, φr） are presented, which reflect the positive effect on the rotational angular momentum j＇ polarization of the DBr product molecule. In addition, two of the polarization-dependent generalized differential cross sections（PDDCSs）, PDDCS00 and PDDCS20, are computed as well. Our results demonstrate that both vector and scalar properties have strong energy dependence.
