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71.
The stable phase equilibria of quaternary systems LiBr-NaBr-MgBr2-H2O and LiBr-KBr-MgBr2-H2O at 298.15 K were studied by both experimental measurement(isothermal solution saturation method) and theoretical prediction(Pitzer model). The solubilities of the saturated solution have been determined experimentally and two stable phase diagrams and relevant water diagrams of the two quaternary systems were obtained. Results show that quaternary system LiBr-NaBr-MgBr2-H2O is hydrate II type as NaBr and NaBr·2H2O coexistence. Its phase diagram consists of only one invariant point, four univariant curves, and five crystallization fields. The quaternary system LiBr-KBr-MgBr2-H2O is a complex type as the double salt KBr·MgBr2·6H2O formed. In addition to this double salt, the three single salts LiBr·2H2O, KBr and MgBr2·6H2O also crystallize. In this paper, the solubilities of phase equilibria in above quaternary systems were also calculated by the Pitzer's electrolyte solution model. All the needed parameters can be obtained from the literature or be fitted by experimental data. On the Basis of the experimental and calculated results, the phase diagram of the quaternary system was plotted for comparison. It shows that the calculation results are consistent with the experimental ones. 相似文献
72.
New thermoelectric materials, n-type Bi6Cu2Se4O6 oxyselenides, composed of well-known BiCuSeO and Bi2O2Se oxyselenides, are synthesized with a simple solid-state reaction. Electrical transport properties, microstructures, and elastic properties are investigated with an emphasis on thermal transport properties. Similar to Bi2O2Se, it is found that the halogen-doped Bi6Cu2Se4O6 possesses n-type conducting transports, which can be improved via Br/Cl doping. Compared with BiCuSeO and Bi2O2Se, an extremely low thermal conductivity can be observed in Bi6Cu2Se4O6. To reveal the origin of low thermal conductivity, elastic properties, sound velocity, Grüneisen parameter, and Debye temperature are evaluated. Importantly, the calculated phonon mean free path of Bi6Cu2Se4O6 is comparable to the interlayer distance for BiO─CuSe and BiO─Se layers, which is ascribed to the strong interlayer phonon scattering. Contributing from the outstanding low thermal conductivity and improved electrical transport properties, the maximum ZT ≈0.15 at 823 K and ≈0.11 at 873K are realized in n-type Bi6Cu2Se3.2Br0.8O6 and Bi6Cu2Se3.6Cl0.4O6, respectively, indicating the promising thermoelectric performance in n-type Bi6Cu2Se4O6 oxyselenides. 相似文献
73.
Benni Du 《Molecular physics》2020,118(2)
Kinetics and mechanism of the gas-phase reaction of CH3C(O)OCH(CH3)CH2OCH3 (MPA) with OH radicals in the presence of O2 and NO have been investigated theoretically by performing a high and reliable level of theory, viz., CCSD(T)/6-311?+?G(d,p)//BH&HLYP/6-311++G(d,p)?+?0.9335×ZPE. The calculations predict that the H-abstraction from the ?CH2?O? position of MPA is the most facile channel, which leads to the formation of the corresponding alkoxy radicals CH3C(O)OCH(CH3)C(O ?)HOCH3 under atmospheric conditions. This activated radicals CH3C(O)OCH(CH3)C(O ?)HOCH3 will undergo further rearrangement, fragmentation and oxidative reactions and predominantly leads to the formation of various products (methyl formate HC(O)OCH3 and acetic anhydride CH3C(O)OC(O)CH3). In the presence of water, acetic anhydride can convert into acetic acid CH3C(O)OH via the hydrolysis reaction. The calculated total rate constants over the temperature range 263–372?K are used to derive a negative activation energy (Ea= ?5.88 kJ/mol) and an pre-exponential factor (A?=?1.78×10?12 cm3 molecule?1 s?1). The obtained Arrhenius parameters presented here are in strong agreement with the experimental values. Moreover, the temperature dependence of the total rate constant over a temperature range of 263?1000?K can be described by k?=?5.60 × 10?14×(T/298?K)3.4×exp(1725.7?K/T) cm3 molecule?1 s?1. 相似文献
74.
A. Othman Almatroud Amina-Aicha Khennaoui Adel Ouannas Giuseppe Grassi M. Mossa Al-sawalha Ahlem Gasri 《Entropy (Basel, Switzerland)》2020,22(12)
This article proposes a new fractional-order discrete-time chaotic system, without equilibria, included two quadratic nonlinearities terms. The dynamics of this system were experimentally investigated via bifurcation diagrams and largest Lyapunov exponent. Besides, some chaotic tests such as the 0–1 test and approximate entropy (ApEn) were included to detect the performance of our numerical results. Furthermore, a valid control method of stabilization is introduced to regulate the proposed system in such a way as to force all its states to adaptively tend toward the equilibrium point at zero. All theoretical findings in this work have been verified numerically using MATLAB software package. 相似文献
75.
In this paper we report the desgin and synthesis of dihydroxyindoles oligomers based reversible fluorescence sensor.We find dihydroxyindoles-2-carboxylic acid derived oligmer(P-DHICA)has the highest selectivity and sensitivity for Cu^2+detection.This work provide a highly efficient,environmentally friendly biosensor for potential use in medical testing. 相似文献
76.
结合教师科研项目,推荐一个精细化工专业实验:疏水缔合聚合物的制备、表征及性能测定。通过该实验可以使学生掌握自由基共聚法制备聚合物的基本原理,掌握一些大型仪器的基本操作、聚合物常用的表征手段及结构分析方法,理解疏水缔合聚合物结构与性能之间深层次的理论联系。该实验项目来源于科研,服务于实践,集聚合反应、结构表征、大分子溶液理化性能测试于一体,具有综合性、前沿性、研究性等特点。本实验的开设有利于提高精细化工方向学生的专业实验水平,提升学生的综合探究素质、创新意识及动手能力。 相似文献
77.
Gold nanostars(Au NSs) are asymmetric anisotropic nanomaterials with sharp edge structure. As a promising branched nanomaterial, Au NS has excellent plasmonic absorption and scattering properties. In order to tune the plasmonic photothermal and surface-enhanced Raman scattering(SERS) activity of Au NSs to obtain the desired characteristics, the effects of reagents on the local surface plasmon resonance(LSPR) bands of Au NSs were studied and the morphology and size were regulated. Nanoparticles with different sharp edges were synthesized to make their local plasmon resonance mode tunable in the visible and near-infrared region. The effects of the number and sharpness of different tips under the control of AgNO3 on the photothermal response of Au NSs and the SERS activity and their mechanism were discussed in detail. The results show that as the length of the branch tip becomes longer and the sharpness increases, the plasmonic photothermal effect of Au NSs is strengthened, and the photothermal conversion efficiency is the highest up to 40% when the length of Au NSs is the longest. Au NSs with high SERS activity are used for the Raman detection substrate. Based on this property, the quantitative detection of the pesticide thiram is achieved. 相似文献
78.
The studies of electron transport through a junction of topological materials in the literature so far ignore the coupling of a topological material to its surrounding environment. Here, the dynamics of an open system through a stochastic Hamiltonian are simulated to investigate the influence of the environment on the scattering of electrons by a junction of different topological materials, such as a Dirac–Weyl magnetic junction and a topological insulator. It is found that, although the detrimental effect of the environment is inevitable, the Landauer conductance can be enhanced via adjusting the system–environment coupling strength. This result supplies the possibilty of changing the transport feature of topological materials by modulating the surrounded environment. It is also demonstrated that a non-Hermitian Hamiltonian can be used to replace the stochastic Hamiltonian for this study, when the system and the environment coupling are weak. 相似文献
79.
Wei Wei Shu-Hua Yang Ze-Han Bao Chong Zhang Chang Gao Wei-Ru Fan 《中国物理C(英文版)》2020,44(9):094104-094104-10
80.
Alena A. Nastulyavichus Irina N. Saraeva Andrey A. Rudenko Roman A. Khmelnitskii Alexander L. Shakhmin Demid A. Kirilenko Pavel N. Brunkov Nikolay N. Melnik Nikita A. Smirnov Andrey A. Ionin Sergey I. Kudryashov 《Particle & Particle Systems Characterization》2020,37(5):2000010
Si nanoparticles (NPs), which are innovative promising light-harvesting components of thin-film solar cells and key-enabling biocompatible theranostic elements of infrared-laser and radiofrequency hyperthermia-based therapies of cancer cells in tumors and metastases, are significantly advanced in their near/mid-infrared band-to-band and free-carrier absorption via donor sulfur-hyperdoping during high-throughput facile femtosecond-laser ablative production in liquid carbon disulfide. High-resolution transmission electron microscopy and Raman microscopy reveal their mixed nanocrystalline/amorphous structure, enabling the extraordinary sulfur content of a few atomic percents and very minor surface oxidation/carbonization characterized by energy-dispersive X-ray spectroscopy and X-ray photoelectron spectroscopy. A 200-nm thick layer of the nanoparticles exhibits near−mid-infrared absorbance, comparable to that of the initial 380-micron thick n-doped Si wafer (phosphor-dopant concentration ≈1015 cm−3), with the corresponding extinction coefficient for the hyperdoped NPs being 4–7 orders higher over the broadband spectral range of 1–25 micrometers. Such ultimate, but potentially tunable mid-IR structured, multi-band absorption of various sulfur-impurity clusters and smooth free-carrier absorption are break through advances in mid-infrared (mid-IR) laser and radiofrequency (RF) hyperthermia-based therapies, as envisioned in the RF-heating tests, and in fabrication of higher-efficiency thin-film and bulk photovoltaic devices with ultra-broad (UV−mid-IR) spectral response. 相似文献