The electronic structure of protein chains L and M in photosynthetic reaction center (PRC) of Rhodobacter sphaeroides (Van Niel) Imhoff, Truper et Pfennig) was studied by using the Overlapping Dimer Approximation meth...The electronic structure of protein chains L and M in photosynthetic reaction center (PRC) of Rhodobacter sphaeroides (Van Niel) Imhoff, Truper et Pfennig) was studied by using the Overlapping Dimer Approximation method and the Extended Negative Factor Counter method at ab initio level. The result indicated that: (1) Amino acid residues, the molecular orbitals of which composed the main components of frontier orbitals of protein chain L (M), are located at the random coil areas of chain L (alpha helix areas of chain M). Since the random coil is flexible and more easy to change its conformation in the electron transfer process and to reduce the energy of the system, and the structure of the alpha helix is reletively stable, this difference might be one of the causes for the electron transfer in photosynthetic reaction center (PRC) only takes place along the L branch. (2) The His residues which axially coordinated to the 'special pair' P and accessory chlorophyll molecules (ABChls) are essentially important for the E-LUMO levels of P and ABChl. But, the corresponding molecular orbitals of these His residues do not appear in the composition of frontier orbitals of protein chains. It means that the interaction between pigment molecules and protein chains do not influence the contribution to the frontier orbitals of protein chains explicitly, but influences the corresponding E-LUMO levels significantly.展开更多
Two cases of the nested configurations in R3 consisting of two regular quadrilaterals are discussed. One case of them do not form central configuration, the other case can be central configuration. In the second case ...Two cases of the nested configurations in R3 consisting of two regular quadrilaterals are discussed. One case of them do not form central configuration, the other case can be central configuration. In the second case the existence and uniqueness of the central configuration are studied. If the configuration is a central configuration, then all masses of outside layer are equivalent, similar to the masses of inside layer. At the same time the following relation between r(the ratio of the sizes) and mass ratio b = m/m must be satisfied in which the masses at outside layer are not less than the masses at inside layer, and the solution of this kind of central configuration is unique for the given ratio (6) of masses.展开更多
Under the necessary conditions for a double pyramidal central configuration with a diamond base to exist in the real number space, the existence and uniqueness of such configurations were studied by employing combined...Under the necessary conditions for a double pyramidal central configuration with a diamond base to exist in the real number space, the existence and uniqueness of such configurations were studied by employing combinedly the algebraic method and numerical calculation. It is found that there exists a planar curl triangle region G in a square Q such that any point in G and given by the ratio of the two diagonal lengths of the diamond base and the ratio of one diagonal length of the base to the height of the double pyramid configuration determines a unique double pyramid central configuration, while all points in Q-G have no referance to any central configuration.展开更多
The study concerns the use of MgCl2-supported high-activity Ziegler-Natta catalysts for the polymerization of ethylene.In particular,two types of catalysts were investigated,which were N-catalyst(BRICI)and improved ...The study concerns the use of MgCl2-supported high-activity Ziegler-Natta catalysts for the polymerization of ethylene.In particular,two types of catalysts were investigated,which were N-catalyst(BRICI)and improved polyethylene catalyst.The effects of catalyst structure on kinetic behavior were examined.The distribution of active centers in these catalysts was investigated by energy dispersive analysis by X-rays(EDAX),and morphologies of catalyst particles and polymer products were examined by scanning electron microscope(SEM).Hydrogen response and copolymerization performance were investigated and compared with the two catalysts.The results were correlated with the kinetic behavior of the two catalysts and appropriate models for polymer particle growth were presented.The improved polyethylene catalyst showed higher activity,better hydrogen response and copolymerization performance.展开更多
On some necessary conditions for double pyramidal central configurations with concave heptagon for any given ratio of masses, the existence and uniqueness of a class of double pyramidal central configurations with con...On some necessary conditions for double pyramidal central configurations with concave heptagon for any given ratio of masses, the existence and uniqueness of a class of double pyramidal central configurations with concave heptagon base for nine-body problems is proved in this paper, and the range of the ratio cr of the circularity radius of the heptagon to the half-height of the double pyramidal central configuration involved in this class configurations is obtained, which is in the interval (√3/3,1.099 600 679), and the configuration involved in the bodies with any σ∈ (√3/3, 1.099 600 679) can form a central configuration which is a uniquely central configuration is proved.展开更多
The influence of chemical composition and cold deformation on aging precipitation behavior of 18Cr-16Mn-2Mo-I.IN (HNS-A), 18Cr-16Mn-I.3N (HNS-B), 18Cr-18Mn-2Mo-0.96N (HNS-C) and 18Cr-18Mn-2Mo-0.77N (I-INS-D) h...The influence of chemical composition and cold deformation on aging precipitation behavior of 18Cr-16Mn-2Mo-I.IN (HNS-A), 18Cr-16Mn-I.3N (HNS-B), 18Cr-18Mn-2Mo-0.96N (HNS-C) and 18Cr-18Mn-2Mo-0.77N (I-INS-D) high nitrogen austenitic stainless steels was investigated. The results show that the "nose" temperatures and incubation periods of the initial time-temperature-precipitation (TTP) curves of aged HNSs are found to be 850 ℃, 60 s; 850 ℃, 45 s; 850 ℃, 60 s and 900 ℃, 90 s, respectively. Based on the analysis of SAD patterns, the coarse cellular Cr2N precipitate which presents a lamellar structure has a hexagonal structure of a=0.478 nm and c=0.444 nm. The Z phase corresponding to a composition of Fe36Cr^2Mo10, is determined to be a body-centered cubic structure ofa=0.892 nm. The precipitating sensitivity presents no more difference with the nitrogen content increasing from 0.77% to 0.96%, but exhibits so obviously that the cellular precipitates nearly overspread the whole field. The addition of Mo element can restrain the TTP curves moving left and down, which means decreasing the sensitivity of aging precipitation. With increasing the cold deformation, the sensitivity of precipitation increases obviously.展开更多
Based on some necessary conditions for double pyramidal central configurations with a concave pentagonal base, for any given ratio of masses, the existence and uniqueness of a class of double pyramidal central configu...Based on some necessary conditions for double pyramidal central configurations with a concave pentagonal base, for any given ratio of masses, the existence and uniqueness of a class of double pyramidal central configurations with a concave pentagonal base in 7-body problems are proved and the range of the ratio between radius and half-height is obtained, within which the 7 bodies involved form a central configuration or form uniquely a central configuration.展开更多
文摘The electronic structure of protein chains L and M in photosynthetic reaction center (PRC) of Rhodobacter sphaeroides (Van Niel) Imhoff, Truper et Pfennig) was studied by using the Overlapping Dimer Approximation method and the Extended Negative Factor Counter method at ab initio level. The result indicated that: (1) Amino acid residues, the molecular orbitals of which composed the main components of frontier orbitals of protein chain L (M), are located at the random coil areas of chain L (alpha helix areas of chain M). Since the random coil is flexible and more easy to change its conformation in the electron transfer process and to reduce the energy of the system, and the structure of the alpha helix is reletively stable, this difference might be one of the causes for the electron transfer in photosynthetic reaction center (PRC) only takes place along the L branch. (2) The His residues which axially coordinated to the 'special pair' P and accessory chlorophyll molecules (ABChls) are essentially important for the E-LUMO levels of P and ABChl. But, the corresponding molecular orbitals of these His residues do not appear in the composition of frontier orbitals of protein chains. It means that the interaction between pigment molecules and protein chains do not influence the contribution to the frontier orbitals of protein chains explicitly, but influences the corresponding E-LUMO levels significantly.
基金Supported by the NSF of China(10231010)Supported by the NSF of CQSXXY (20030104)
文摘Two cases of the nested configurations in R3 consisting of two regular quadrilaterals are discussed. One case of them do not form central configuration, the other case can be central configuration. In the second case the existence and uniqueness of the central configuration are studied. If the configuration is a central configuration, then all masses of outside layer are equivalent, similar to the masses of inside layer. At the same time the following relation between r(the ratio of the sizes) and mass ratio b = m/m must be satisfied in which the masses at outside layer are not less than the masses at inside layer, and the solution of this kind of central configuration is unique for the given ratio (6) of masses.
文摘Under the necessary conditions for a double pyramidal central configuration with a diamond base to exist in the real number space, the existence and uniqueness of such configurations were studied by employing combinedly the algebraic method and numerical calculation. It is found that there exists a planar curl triangle region G in a square Q such that any point in G and given by the ratio of the two diagonal lengths of the diamond base and the ratio of one diagonal length of the base to the height of the double pyramid configuration determines a unique double pyramid central configuration, while all points in Q-G have no referance to any central configuration.
文摘The study concerns the use of MgCl2-supported high-activity Ziegler-Natta catalysts for the polymerization of ethylene.In particular,two types of catalysts were investigated,which were N-catalyst(BRICI)and improved polyethylene catalyst.The effects of catalyst structure on kinetic behavior were examined.The distribution of active centers in these catalysts was investigated by energy dispersive analysis by X-rays(EDAX),and morphologies of catalyst particles and polymer products were examined by scanning electron microscope(SEM).Hydrogen response and copolymerization performance were investigated and compared with the two catalysts.The results were correlated with the kinetic behavior of the two catalysts and appropriate models for polymer particle growth were presented.The improved polyethylene catalyst showed higher activity,better hydrogen response and copolymerization performance.
基金Funded by NSF (Natural Science Foundation) of China (No. 10231010) and NSF of Chongqing Educational Committee (KJ051109, KJ06110X), NSF of Chongqing Science and Technology Committee, NSF of CQSXXY
文摘On some necessary conditions for double pyramidal central configurations with concave heptagon for any given ratio of masses, the existence and uniqueness of a class of double pyramidal central configurations with concave heptagon base for nine-body problems is proved in this paper, and the range of the ratio cr of the circularity radius of the heptagon to the half-height of the double pyramidal central configuration involved in this class configurations is obtained, which is in the interval (√3/3,1.099 600 679), and the configuration involved in the bodies with any σ∈ (√3/3, 1.099 600 679) can form a central configuration which is a uniquely central configuration is proved.
基金Project(51304041) supported by the National Natural Science Foundation of ChinaProject(N100402015) supported by Fundamental Research Funds for the Central Universities of China+1 种基金Project(2012AA03A502) supported by the National High Technology Research and Development Program of ChinaProject supported by Program for Liaoning Innovative Research Team in University,China
文摘The influence of chemical composition and cold deformation on aging precipitation behavior of 18Cr-16Mn-2Mo-I.IN (HNS-A), 18Cr-16Mn-I.3N (HNS-B), 18Cr-18Mn-2Mo-0.96N (HNS-C) and 18Cr-18Mn-2Mo-0.77N (I-INS-D) high nitrogen austenitic stainless steels was investigated. The results show that the "nose" temperatures and incubation periods of the initial time-temperature-precipitation (TTP) curves of aged HNSs are found to be 850 ℃, 60 s; 850 ℃, 45 s; 850 ℃, 60 s and 900 ℃, 90 s, respectively. Based on the analysis of SAD patterns, the coarse cellular Cr2N precipitate which presents a lamellar structure has a hexagonal structure of a=0.478 nm and c=0.444 nm. The Z phase corresponding to a composition of Fe36Cr^2Mo10, is determined to be a body-centered cubic structure ofa=0.892 nm. The precipitating sensitivity presents no more difference with the nitrogen content increasing from 0.77% to 0.96%, but exhibits so obviously that the cellular precipitates nearly overspread the whole field. The addition of Mo element can restrain the TTP curves moving left and down, which means decreasing the sensitivity of aging precipitation. With increasing the cold deformation, the sensitivity of precipitation increases obviously.
基金Natural Science Foundation of China (No.19871096)
文摘Based on some necessary conditions for double pyramidal central configurations with a concave pentagonal base, for any given ratio of masses, the existence and uniqueness of a class of double pyramidal central configurations with a concave pentagonal base in 7-body problems are proved and the range of the ratio between radius and half-height is obtained, within which the 7 bodies involved form a central configuration or form uniquely a central configuration.