Ab initio structure and vibration-rotation dynamics of germylene,GeH2

Accurate structure and potential energy surface of germylene, GeH₂, in its ground electronic state ¹A₁ were determined from ab initio calculations using the coupled-cluster approach in conjunction with the correlation-consistent basis sets up to sextuple-zeta quality. The Born-Oppenheimer equilibrium structural parameters for the ¹A₁ state are estimated to be r_e(GeH) = 1.5793 Å and ∠_e(HGeH) = 91.19^∘. The term value T_e for the lowest excited electronic state ã³B₁ of GeH₂ is predicted to be 9140 cm^–1. The vibration-rotation energy levels for the ¹A₁ state of the ⁷⁴GeH₂, ⁷⁴GeD₂, ⁷²GeH₂, and ⁷⁰GeH₂ isotopologues were determined using a variational approach and compared with the experimental data. The role of the core-electron correlation, higher-order valence-electron correlation, scalar relativistic, spin-orbit, and adiabatic effects for prediction of the structure and vibration-rotation dynamics of the GeH₂ molecule is discussed. © 2019 Wiley Periodicals, Inc.     

Experimental study of the cavitation noise and vibration induced by the choked flow in a Venturi reactor

In this paper, the cavitation performance and corresponding pressure pulsation, noise and vibration induced by the choked cavitating flow in a Venturi reactor are investigated experimentally under different cavitation conditions by using high-speed camera and high frequency sensors. Based on the instantaneous continuous cavitation images, the Proper Orthogonal Decomposition (POD), a tool to analyze the large-scale cavitation flow structure, is applied to investigate the choked cavitating flow dynamics. The POD results show that two mechanisms, re-entrant jet flow mechanism and shock wave mechanism, govern the shedding and collapse of cavitation cloud at different pressure ratios. These mechanisms contribute to the variation of pressure pulsation, noise and vibration at different pressure ratios. The pressure pulsation spectrum behaves differently in various cavitation regions induced by the choked cavitating flow. Due to the existence of low pressure in re-entrant region, the influence of high frequency fluctuation on pressure pulsation caused by re-entrant flow is small. Moreover, with the increase of pressure ratio, the induced noise and vibration intensity decreases gradually, then increases and reaches a maximum value. Finally, it drops to a low and stable level. Despite different inlet pressures, the intensity of cavitation noise and vibration reaches the maximum value at the same pressure ratio. Specifically, the FFT analysis of noise and vibration signals indicates that low frequency component prevails at small pressure ratio owing to the re-entrant jet mechanism, while high frequency component prevails at large pressure ratio owing to the shock wave mechanism. The relationship between the choked cavitation dynamics and the induced pressure pulsation, noise and vibration in the Venturi reactor is highlighted. The results can provide guidance for the optimal operation condition of the Venturi reactor for cavitation applications such as water treatment.     

Wave-based vibration control of large cable net structures

Large cable net structures have been widely applied in aerospace engineering due to the feature of light-weight, high packaging efficiency, and high thermal stability. Structural vibrations induced by a variety of disturbances are inevitable in the space environment, resulting in the requirement of effective vibration control strategies for large cable net structures. Since the large cable net structures have many closely spaced vibrational modes in the range of low frequencies, traditional modal based control may cause modal truncation and spillover problems. In this paper, a wave-based boundary control strategy is adopted and its effectiveness to control the vibration of cable net structures is investigated, by transfer function analysis and numerical methods. It is found that the structural vibration can be absolutely resisted by applying the wave-based boundary controllers onto all the exterior nodes, when disturbances come from the external boundaries of the cable net. Our results in this paper can provide a theoretical basis for the vibration control of large cable net structures.     

熵的一种通俗教法

熵如力、能量和动量一样是物理学中一个重要概念,若能用一种通俗易懂的方法设计熵的教学,对文科物理的教学有重要意义.为此本文提出了一种通俗的熵的教法,这一教法不需要学生学习热力学第二定律也可以建立熵的概念.具体教学设计如下:通过日常生活例子引入熵的概念(也就是玻尔兹曼熵),设计两个例子让学生会计算熵,通过具体问题的讨论让学生充分理解熵的意义,通过一个实例由玻尔兹曼熵引入克劳修斯熵公式,设计一个演示实验强化教学效果,将熵与环境保护联系起来融入人文情怀,最后还强调了熵计算的不同层次.教学设计完全采用基于问题学习(PBL)的教学模式.     

Sloshing and energy dissipation in an egg: SPH simulations and experiments

Tall structures, such as towers and bridges, can oscillate at excessive magnitudes when subjected to wind and earthquake loads. Liquid sloshing absorbers can be used to suppress these excessive oscillations by tuning the frequency of the sloshing to the critical frequency of the structure. Sloshing absorbers are simple structures consisting of a partially full container of liquid with a free surface. Tuning ensures that significant amounts of harmful energy can be extracted from the structure to the sloshing liquid. However, there needs to be a rapid means of dissipating this energy to avoid its returning back to the structure (then back to the liquid periodically).A hen׳s egg seems to have evolved to efficiently dissipate energy to protect its embryo using sloshing of its liquid content. Hence, the potential to implement the egg׳s unique properties as a sloshing absorber for structural control, is the main focus of this study. Numerical simulations, using Smoothed Particle Hydrodynamics (SPH), and experimental comparisons are presented in this paper. One objective is to demonstrate the ability of SPH to simulate complex free surface behaviour in three dimensions. Such a tool is then useful to identify different dissipation modes. Effects of fill volume and viscosity on the rate of dissipation, are also investigated.     

Structural and luminescence characteristics of CuAlxIn1−xSe2 (0 < x ≤ 0.30) chalcopyrite solid solutions

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Influence of moisture and CO2 on the material behavior of thermoplastic elastomers for beer bottle closures

Metal closures with a polymer-based sealing for beer bottles have been known since the late nineteen-sixties. However, to what extent which parameter of the polymer sealing gasket plays a role in closure performance to keep the beer quality to a highest level possible is not fully understood. For this purpose three thermoplastic elastomer (TPE) liners were investigated by differential scanning calorimetry (DSC), Fourier transform infrared (FTIR) spectrometry, dynamical mechanical analysis (DMA), scanning electron microscopy (SEM) and surface roughness in order to understand the effect of relative humidity (RH) and carbon dioxide (CO₂) on their physical and chemical properties as well as their macromolecular structures. The TPEs’ viscoelasticity in the frequency domain under different isothermal conditions was evaluated. RH and CO₂ were effective for changes in thermomechanical and surface properties. Liner C was found to have lower seal performance attributed to its relatively higher crystallinity, stiffness, weaker bond structure and rougher surface. Vibrations can lead to seal leakage in Liner B due to its higher damping behavior during production and transportation. Liner A outperforms others due to stabile behavior within the operational temperature range.     

氪原子的近红外吸收光谱的研究

本文利用浓度调制的万法测量了氪原子在11870～12700 cm~(-1)波段的高分辨连续吸收光谱.在实验中,通过对氪气和氦气混合气体进行放电的方法制备氪原子.总共测量了120根氦原子吸收谱线,其中33根谱线是已被报道过的,45根新测量的谱线可以通过已知的氪原子能级进行标定,其它剩下的42根新测量的谱跃迁线根据已知的氪原子能级信息尚无法进行标定.本次实验中的这些未知的42根氪原子的跃迁谱线,可以推断氪原子有尚未被报道或测量过的原子能级存在.本文同时对如何用"Classification"计算软件分析未知氪原子谱线的可能存在的能级进行了演示.     

Passive vibration absorber effect on the machining surface quality of a flexible workpiece

This paper presents a study of the vibratory behaviour of a flexible workpiece subject to a milling end operation. Indeed, this vibratory behaviour is critical, especially when the excitation frequency is near to the resonance. For this reason, passive vibration suppression is considered in order to attenuate the dynamic response of the milled workpiece and decrease the dynamic effect on the resulting machined surface roughness and flatness. In order to confirm the efficiency of the passive vibration suppression, the vibratory behaviour and the quality (roughness and flatness) of a machined surface are studied without and with passive absorber (TMD) using a finite-element model.     

Monodisperse Six-Armed Starbursts based on Truxene-Cored Multibranched Oligofluorenes: Design,Synthesis, and Stabilized Lasing Characteristics

A series of monodisperse six-armed conjugated starbursts ( Tr1F , Tr2F , and Tr3F ) containing a truxene core and multibranched oligofluorene bridges capped with diphenylamine (DPA) units has been designed, synthesized, and investigated as robust gain media for organic semiconductor lasers (OSLs). The influence of electron-rich DPA end groups on their optoelectronic characteristics has been discussed at length. DPA cappers effectively raise HOMO levels of the starbursts, thus enhancing the hole injection and transport ability. Solution-processed electroluminescence devices based on the resulting six-armed starbursts exhibited efficient deep-blue electroluminescence with clear reduced turn-on voltages (3.2–3.5 V). Moreover, the resulting six-armed molecules showed stabilized electroluminescence and amplified spontaneous emission with low thresholds (27.4–63.9 nJ pulse⁻¹), high net gain coefficients (80.1–101.3 cm⁻¹), and small optical loss (2.6–4.4 cm⁻¹). Distributed feedback OSLs made from Tr3F exhibited a low lasing threshold of 0.31 kW cm⁻² (at 465 nm). The results suggest that the construction of truxene-centered six-armed conjugated starbursts with the incorporation of DPA units can effectively enhance EL properties by precisely regulating the HOMO energy levels, and further optimizing their optical gain properties.