Discrimination of Excited States of Acetylacetone through Theoretical Molecular-Frame Photoelectron Angular Distributions

Photoelectron angular distribution (PAD) in the laboratory frame for randomly oriented molecules is typically described by a single anisotropy parameter, the so-called asymmetry parameter. However, especially from a theoretical perspective, it is more natural to consider molecular photoionization by using a molecular frame. The molecular frame PADs (MFPADs) may be used to extract information about the electronic structure of the system studied. In the last decade, significant experimental efforts have been directed to MFPAD measurements. MFPADs are highly characterizing signatures of the final ionic states. In particular, they are very sensitive to the nature of the final state, which is embodied in the corresponding Dyson orbital. In our previous work on acetylacetone, a prototype system for studying intra-molecular hydrogen bond interactions, we followed the dynamics of the excited states involved in the photoexcitation–deexcitation process of this molecule. It remains to be explored the possibility of discriminating between different excited states through the MFPAD profiles. The calculation of MFPADs to differentiate excited states can pave the way to the possibility of a clear discrimination for all the cases where the recognition of excited states is otherwise intricate.     

自聚焦透镜高效批量加工的双面研磨抛光法研究

依据双面研磨抛光原理,提出了加工自聚焦透镜平面和斜面辅助工装设计.从工艺技术特点和生产实际过程等方面对设计的工装使用情况进行分析验证.多次大批量加工实践证明,该辅助工装的设计完全满足了自聚焦透镜高效批量加工技术要求,简化整个生产线工艺,减少工艺流程时间,降低材辅料的消耗成本,从而验证了双面研磨抛光法是一种实用的加工自聚焦透镜的新方法.     

Phase diagrams of the mixed spin-1 and spin-1/2 Ising-Heisenberg model on the diamond-like decorated Bethe lattice

The ground-state and finite-temperature behavior of the mixed spin-1 and spin-1/2 Ising-Heisenberg model on the diamond-like decorated Bethe lattice is investigated within the framework of two rigorous methods: the decoration-iteration transformation and exact recursion relations. The model under consideration describes a hybrid classical-quantum system consisting of the Ising and Heisenberg spins, which interact among themselves either through the Ising or XXZ Heisenberg nearest-neighbor interaction. Both sublattice magnetizations of the Ising and Heisenberg spins are exactly calculated with the aim to examine phase diagrams, thermal variations of the total and sublattice magnetizations. The finite-temperature phase diagrams form continuous (second-order) phase transition lines only, which exhibit a small reentrant region if the diamond-like decorated Bethe lattice with a sufficiently high coordination number is considered.     

Lead-free ferroelectric BaTiO3 doped-(Na0.5Bi0.5)TiO3 thin films processed by pulsed laser deposition technique

The difficulties in synthesizing phase pure BaTiO₃ doped-(Na_0.5Bi_0.5)TiO₃ are known. In this work, we reporting the optimized pulsed laser deposition (PLD) conditions for obtaining pure phase 0.92(Na_0.5Bi_0.5)TiO₃-0.08BaTiO₃, (BNT-BT_0.08), thin films. Dielectric, ferroelectric and piezoelectric properties of BNT-BT_0.08, thin films deposited by PLD on Pt/TiO₂/SiO₂/Si substrates are investigated in this paper. Perovskite structure of BNT-BT_0.08 thin films with random orientation of nanocrystallites has been obtained by deposition at 600 °C. The relative dielectric constant and loss tangent at 100 kHz, of BNT-BT_0.08 thin film with 530 nm thickness, were 820 and 0.13, respectively. Ferroelectric hysteresis measurements indicated a remnant polarization value of 22 μC/cm² and a coercive field of 120 kV/cm. The piezoresponse force microscopy (PFM) data showed that most of the grains seem to be constituted of single ferroelectric domain. The as-deposited BNT-BT_0.08 thin film is ferroelectric at the nanoscale level and piezoelectric.     

High temperature stability of maghemite in partially oxidized basalt lava

Mössbauer spectroscopy of basalt lava samples, exhibiting reversible thermal magnetization (J_S-T) curves with Curie temperatures of about 580°C, has revealed considerable amounts of maghemite (γ-Fe₂O₃) in many samples. In view of the expected instability, of maghemite at temperatures above 350°C, this reversibility is rather surprising. Here we report Mössbauer studies on heated lava samples, showing high content of maghemite. The samples were kept at 600°C in oxidizing, reducing, and inactive atmospheres, respectively, for different lengths of time, and then analyzed with Mössbauer spectroscopy at room temperature. The Mössbauer spectra showed that maghemite is stable in the oxidizing atmosphere for at least several hours. In the inactive atmosphere a considerable amount of maghemite still exists after two hours heating. In the reducing atmosphere maghemite had transformed to magnetite after only 30 minutes.     

Lagrange identity method for microstretch thermoelastic materials

Our paper is concerned with some basic theorems for microstretch thermoelastic materials. By using the Lagrange identity, we prove the uniqueness theorem and some continuous dependence theorems without recourse to any energy conservation law, or to any boundedness assumptions on the thermoelastic coefficients. Moreover, we avoid the use of positive definiteness assumptions on the thermoelastic coefficients.     

衍射光学元件衍射效率影响混合光学系统性能的一种分析方法

本文从衍射光学元件的衍射效率入手,详细地分析了衍射光学元件衍射效率同混合光学系统光学传递函数的关系,并通过一个实际例子对所分析的结果进行了深入讨论.     

Influence of the image interaction on ion desorption processes

A classical treatment of the interaction between an ion and a conducting surface during an ion desorption process is presented. Analytical expressions have been obtained for the trajectories of desorbing ions as well as for the trajectories of ions trapped by the image potential. The distortion by the image potential of the energy and angular distribution of desorbing ions is estimated. Our objective has been to provide a guide for experimentalists to the surprisingly large changes in such distributions caused by the image forces.