Based on the Stokes wave theory, the capillary-gravity wave and the interfacial internal wave in two-layer constant depth＇s fluid system are investigated. The fluids are assumed to be incompressible, inviscid and irr...Based on the Stokes wave theory, the capillary-gravity wave and the interfacial internal wave in two-layer constant depth＇s fluid system are investigated. The fluids are assumed to be incompressible, inviscid and irrotational. The third-order Stokes wave solutions are given by using a perturbation method. The results indicate that the third-order solutions depend on the surface tension, the density and the depth of each layer. As expected, the first-order solutions are the linear theoretical results （the small amplitude wave theoretical results）. The second-order and the third-order solutions describe the nonlinear modification and the nonlinear interactions. The nonlinear impact appears not only in the n （n〉~2） times＇ high frequency components, but also in the low frequency components. It is also noted that the wave velocity depends on the wave number, depth, wave amplitude and surface tension.展开更多
UV-Vis spectrum and the third-order nonlinear optical properties of the chiral camphor-derived β-diketonate have been studied at the B3LYP/6-31G＊ level. The results showed that the introduction of electron-drawing g...UV-Vis spectrum and the third-order nonlinear optical properties of the chiral camphor-derived β-diketonate have been studied at the B3LYP/6-31G＊ level. The results showed that the introduction of electron-drawing group -CF3 and -C3F7 on β-diketonate made the strongest absorption peak red-shift and the lowest energy absorption blue-shied. Introduction of -OC2H5 on the benzene or pyridine ring made the lowest energy absorption blue-shift. When the -C2H3 was introduced on the benzene or pyridine ring, the lowest energy absorption was red-shifted. Introduction of electron-donating group on β-diketonate can enlarge their nonlinear optical properties. On the contrary, the introduction of electron-drawing group dropped it down.展开更多
Interracial internal waves in a three-layer density-stratified fluid are investigated using a singular perturbation method, and third-order asymptotic solutions of the velocity potentials and third-order Stokes wave s...Interracial internal waves in a three-layer density-stratified fluid are investigated using a singular perturbation method, and third-order asymptotic solutions of the velocity potentials and third-order Stokes wave solutions of the associated elevations of the interfacial waves are presented based on the small amplitude wave theory. As expected, the third-order solutions describe the third-order nonlinear modification and the third-order nonlinear interactions between the interracial waves. The wave velocity depends on not only the wave number and the depth of each layer but also on the wave amplitude.展开更多
Third-order nonlinear optical (NLO) materials have broad application prospects in high-density data storage, optical computer, modern laser technology, and other high-tech industries. The structures and frequencies of...Third-order nonlinear optical (NLO) materials have broad application prospects in high-density data storage, optical computer, modern laser technology, and other high-tech industries. The structures and frequencies of Dinaphtho[2,3-b:2’,3’-d]thiophene-5,7,12,13-tetraone (DNTTRA) and its 36 derivatives containing azobenzene were calculated by using density functional theory B3LYP and M06-2X methods at 6-311++g(d, p) level, respectively. Besides, the atomic charges of natural bond orbitals (NBO) were analyzed. The frontier orbitals and electron absorption spectra of A-G5 molecule were calculated by TD-DFT (TD-B3LYP/6-311++g(d, p) and TD-M06-2X/6-311++g(d, p)). The NLO properties were calculated by effective finite field FF method and self-compiled program. The results show that 36 molecules of these six series are D-π-A-π-D structures. The third-order NLO coefficients γ (second-order hyperpolarizability) of the D series molecules are the largest among the six series, reaching 10<sup>7</sup> atomic units (10<sup><span style="color:#4F4F4F;font-family:-apple-system, " font-size:14px;white-space:normal;background-color:#ffffff;"="">-</span>33</sup> esu) of order of magnitude, showing good third-order NLO properties. Last, the third-order NLO properties of the azobenzene ring can be improved by introducing strong electron donor groups (e.g. -N(CH<sub>3</sub>)<sub>2</sub> or -NHCH<sub>3</sub>) in the azobenzene ring, so that the third-order NLO materials with good performance can be obtained.展开更多
<正>Mukerjee and Wu(2001) employed projective geometry theory to find the wordlength pattern of a regular mixed factorial design in terms of its complementary set, but only for the numbers of words of length 3 o...<正>Mukerjee and Wu(2001) employed projective geometry theory to find the wordlength pattern of a regular mixed factorial design in terms of its complementary set, but only for the numbers of words of length 3 or 4.In this paper,by introducing a concept of consulting design and based on the connection between factorial design theory and cod- ing theory,we obtain some combinatorial identities that relate the wordlength pattern of a regular mixed-level (2~r)2~n factorial design to that of its consulting design.Consequently,a general rule for identifying minimum aberration (2~r)2~n factorial designs through their con- sulting designs is established.It is an improvement and generalization of the related result in Mukerjee and Wu(2001).展开更多
基金financially supported by the Science Research Project of Inner Mongolia University of Technology,China(Grant No.ZD201613)
文摘Based on the Stokes wave theory, the capillary-gravity wave and the interfacial internal wave in two-layer constant depth＇s fluid system are investigated. The fluids are assumed to be incompressible, inviscid and irrotational. The third-order Stokes wave solutions are given by using a perturbation method. The results indicate that the third-order solutions depend on the surface tension, the density and the depth of each layer. As expected, the first-order solutions are the linear theoretical results （the small amplitude wave theoretical results）. The second-order and the third-order solutions describe the nonlinear modification and the nonlinear interactions. The nonlinear impact appears not only in the n （n〉~2） times＇ high frequency components, but also in the low frequency components. It is also noted that the wave velocity depends on the wave number, depth, wave amplitude and surface tension.
基金supported by the National Natural Science Foundation of China(21172161)
文摘UV-Vis spectrum and the third-order nonlinear optical properties of the chiral camphor-derived β-diketonate have been studied at the B3LYP/6-31G＊ level. The results showed that the introduction of electron-drawing group -CF3 and -C3F7 on β-diketonate made the strongest absorption peak red-shift and the lowest energy absorption blue-shied. Introduction of -OC2H5 on the benzene or pyridine ring made the lowest energy absorption blue-shift. When the -C2H3 was introduced on the benzene or pyridine ring, the lowest energy absorption was red-shifted. Introduction of electron-donating group on β-diketonate can enlarge their nonlinear optical properties. On the contrary, the introduction of electron-drawing group dropped it down.
基金supported by the Natural Science Foundation of Inner Mongolia,China(Grant No 200711020116)Open Fund of the Key Laboratory of Ocean Circulation and Waves,Chinese Academy of Sciences(Grant No KLOCAW0805)+1 种基金the Key Program of the Scientific Research Plan of Inner Mongolia University of Technology,China(Grant No ZD200608)National Science Fund for Distinguished Young Scholars of China(Grant No 40425015)
文摘Interracial internal waves in a three-layer density-stratified fluid are investigated using a singular perturbation method, and third-order asymptotic solutions of the velocity potentials and third-order Stokes wave solutions of the associated elevations of the interfacial waves are presented based on the small amplitude wave theory. As expected, the third-order solutions describe the third-order nonlinear modification and the third-order nonlinear interactions between the interracial waves. The wave velocity depends on not only the wave number and the depth of each layer but also on the wave amplitude.
文摘Third-order nonlinear optical (NLO) materials have broad application prospects in high-density data storage, optical computer, modern laser technology, and other high-tech industries. The structures and frequencies of Dinaphtho[2,3-b:2’,3’-d]thiophene-5,7,12,13-tetraone (DNTTRA) and its 36 derivatives containing azobenzene were calculated by using density functional theory B3LYP and M06-2X methods at 6-311++g(d, p) level, respectively. Besides, the atomic charges of natural bond orbitals (NBO) were analyzed. The frontier orbitals and electron absorption spectra of A-G5 molecule were calculated by TD-DFT (TD-B3LYP/6-311++g(d, p) and TD-M06-2X/6-311++g(d, p)). The NLO properties were calculated by effective finite field FF method and self-compiled program. The results show that 36 molecules of these six series are D-π-A-π-D structures. The third-order NLO coefficients γ (second-order hyperpolarizability) of the D series molecules are the largest among the six series, reaching 10<sup>7</sup> atomic units (10<sup><span style="color:#4F4F4F;font-family:-apple-system, " font-size:14px;white-space:normal;background-color:#ffffff;"="">-</span>33</sup> esu) of order of magnitude, showing good third-order NLO properties. Last, the third-order NLO properties of the azobenzene ring can be improved by introducing strong electron donor groups (e.g. -N(CH<sub>3</sub>)<sub>2</sub> or -NHCH<sub>3</sub>) in the azobenzene ring, so that the third-order NLO materials with good performance can be obtained.
文摘<正>Mukerjee and Wu(2001) employed projective geometry theory to find the wordlength pattern of a regular mixed factorial design in terms of its complementary set, but only for the numbers of words of length 3 or 4.In this paper,by introducing a concept of consulting design and based on the connection between factorial design theory and cod- ing theory,we obtain some combinatorial identities that relate the wordlength pattern of a regular mixed-level (2~r)2~n factorial design to that of its consulting design.Consequently,a general rule for identifying minimum aberration (2~r)2~n factorial designs through their con- sulting designs is established.It is an improvement and generalization of the related result in Mukerjee and Wu(2001).
