原子掺杂对单元材料结晶能力的影响     

彭坤  明辰  叶祥熙  张文献  庄军  宁西京 《海洋学报》2010,32(10):7245-7251

2009年我们建立了一个凝结势模型用以预测材料形成单晶体的能力,表明单元体材料(Ni,Al,Cu,Ar,Mg)的结晶能力随凝结势的增大而单调增强.本文将凝结势模型应用于二元材料体系,并结合分子动力学模拟研究了6% Al原子掺杂对于Ni单晶材料结晶能力的影响.模拟结果发现,Al元素的掺杂会大大减弱Ni单晶的结晶能力,在此基础上提出了二元材料体系凝结势的定义,表明凝结势模型可广泛应用于预测二元体材料的结晶能力.  相似文献   

Improvement in the calculation of anti-Stokes energy transfer and experimental justification based on Er_0.01Yb_xY_{1 - 0.01 - x}VO₄ crystal     

陈晓波  卢建  张蕴芝  徐小灵  冯宝华  王策  Gregory J. Salamo  杨国建 《海洋学报(英文版)》2010,29(9)

The improvement on the calculation of anti-Stokes energy transfer rate is studied in the present work. The additional proportion coefficient between Stokes and anti-Stokes light intensities of quantum Raman scattering theory as compared with the classical Raman theory is introduced to successfully describe the anti-Stokes energy transfer. The theoretical formula for the improvement on the calculation of anti-Stokes energy transfer rate is derived for the first time in this study. The correctness of introducing coefficient exp{ΔE / kT} from well-known Raman scatter theory is demonstrated also. Moreover, the experimental lifetime measurement in Er_0.01Yb_xY_{1 - 0.01 - x}VO₄ crystal is performed to justify the validity of our important improvement in the original phonon-assisted energy transfer theory for the first time.  相似文献   

Brillouin scattering study on elastic and piezoelectric properties of laser irradiated ZnO single crystals     

刘洁  蒋毅坚 《海洋学报(英文版)》2010,29(11)

Brillouin light scattering technique can be successfully used to determine the whole set of elastic and piezoelectric constants of a ZnO single crystal irradiated by different laser energy densities, into a micron range (radiation layer thickness). It is found that the scattering intensity, the linewidth and the Brillouin scattering shift of acoustic phonons are all strongly dependent on laser energy density. Based on the sound propagation equations and these results, the directional dependences of the compressional and shear moduli of the irradiated ZnO sample in the (001) plane are investigated. It is found that under an appropriate laser condition, 248 nm KrF excimer laser irradiation can significantly improve the surface quality and increase the elastic properties of ZnO single crystal. This procedure has potential applications in the fabrication of ZnO-based surface acoustic wave and optic-electronic devices.  相似文献   

铜改性坡缕石的结构特征与抗菌性能研究   总被引：4，自引：0，他引：4  

赵娣芳  周杰  楼必君  刘宁  陈杰 《矿物学报》2006,26(2):219-223

采用液相离子交换法制备了铜改性坡缕石,通过正交实验得到的最佳改性工艺条件为:母液初始浓度为0.02 mol/L,反应温度95℃,常压,反应时间6 h。所制备的Cu2 改性坡缕石对大肠杆菌、金黄色葡萄球菌48 h抑菌率分别达到了87.3%和82.2%。对铜改性坡缕石的晶体结构特征和微观形貌的测定和分析结果表明,铜改性坡缕石仍然保持着坡缕石的基本晶体结构,但结晶度有所降低,晶体颗粒更易分散,单晶表面略显粗糙,单晶的长度有所变小。  相似文献   

高密度聚乙烯/纳米辉钼矿复合材料性能研究     

吴伟端  周丽春  郭胜平  牛牧童  肖凤英  赵煌 《矿物学报》2006,26(3):281-284

以径厚为30~45 nm的辉钼矿作为导电填料,采用熔融共混法制备高密度聚乙烯/纳米辉钼矿复合材料,应用高阻计ZC-36、SEM、XRD、TG等研究复合材料的电性能、晶体结构、界面微观形貌、热性能等。研究结果表明:当纳米辉钼矿含量为25%,复合材料的体积电阻率为5.1×109Ωcm,纳米辉钼矿高定向排列,呈链状集合体;复合材料tonset分解温度提高了35℃;辉钼矿的晶体结构发生变化,(002)晶面2θ右移了1.12°,面间距缩小0.257 nm。  相似文献   

Structure Refinement of Cs-rich Na-Li Beryl and Analysis of Its Typomorphic Characteristics of Configurations     

LIU Yan  DENG Jun  LI Guowu  SHI Guanghai  State Key Laboratory of Geological Processes  Mineral Resources  China University of Geosciences  Beijing Key Laboratory of Lithosphere Tectonics  Lithoprobing Technology of the Ministry of Education  China University of Geosciences  Beijing Laboratory of Single-Crystal X-Ray Diffraction  China University of Geosciences  Beijing 《《地质学报》英文版》2007,81(1):61-67

1 Introduction Natural beryl is an accessory mineral mainly in pegmatite, partly in some highly diffractionated granite or metamorphic rocks, with the crystal shapes beingprismatic, or occasionally tabular. For tabular beryl found in pegmatite it is believed that the tabular configuration is connected with alkali metals (Bieus, 1960; Wang et al., 1981) and geneses of the tabular configuration have been reported before. In recent years, tabular beryl has been found in the Xuebaoding W-Sn-Be d…  相似文献   

The Weixi High-silica Granitoids in the Central Sanjiang Orogenic Belt, Southwest China: Implications for Growth of the Continental Crust     

WANG Qiuyu  CHEN Shouming  ZHANG Hongrui  LI Saisai 《《地质学报》英文版》2024,98(3):641-656

High-silica granitoids record the formation and evolution of the continental crust. A new intrusive complex has been recognized among silicic volcanic rocks of the Weixi arc, Southwest China. The intrusions consist of granites, granitic porphyries, and granodiorites. Zircon U-Pb age data indicate that the Weixi granitoids formed at 248–240 Ma and were coeval with silicic volcanic rocks of the Weixi arc. The Weixi granitoids are enriched in Rb, Th, and U, depleted in Ba, Sr, Nb, Ta, and Ti, and have high light/heavy rare earth element ratios and slightly negative Eu anomalies. The Weixi granitoids have negative εNd(t) values (?9.8 to ?7.8) and negative zircon εHf(t) values (?12.02 to ?5.11). The geochemical and isotopic features suggest the Weixi granitoids were derived by partial melting of ancient crustal material. The Weixi granitoids and silicic volcanic rocks were derived from the same magma by crystal accumulation and melt extraction, respectively, and they record the formation of a continental arc in the central Sanjiang orogenic belt.  相似文献   

Crystallographic and NMR studies on sterols from green alga Chaetomorpha basiretorsa Setchell     

SHI Dayong  XU Feng  HE Juan  SHI Jiangong  FAN Xiao  HAN Lijun 《海洋学报(英文版)》2008,27(1):147-151

Chemical investigation of the ethanol extract of the marine green alga Chaetomorpha basiretorsa Setchell led to the isolation of a new sterol stigmast-4,28-dien-3α,6β-diol 1 in addition to the five known sterols of β-lawsaritol 2, saringosterol 3, 24-hydroperoxy-24-vinyl - cholesterol 4, β-stigmasterol 5, 29-hydroxystigmasta-5, 24 （28） -dien-3β-ol 6. Compounds were isolated by normal phase silica gel and Sephadex LH - 20 gel colum chromatography, reverse phase HPLC and recrystalization. Their structures were elucidated by spectroscopic methods including MS, IR 1D/2D NMR and X-ray analysis. Cytotoxicity of compounds was screened by using the standard MTF method. All these compounds were isolated from the green alga Chaetomorpha basiretorsa Setchell for the first time and they were inactive （50% inhibitory concentration was greater than 10 μg/cm^3） against KB, Bel -7402, PC - 3M, Ketr 3 and MCF-7 cell lines.  相似文献   

Crystal Structure and Geometry-Optimization Study of N-(2-hydroxy-1-naphthaldene)-4-aminoantipyrme     

GUO Feng  BI Caifeng  FAN Yuhua  WANG Aidong  XU Jiakun  ZHANG Xia 《中国海洋大学学报(英文版)》2008,7(2)

N-(2-hydroxy-1-naphthaldene)-4-aminoantipyrine has been synthesized. The structure is determined by X-ray diffraction method and elemental analysis. The crystal system belongs to orthorhombic space group P(2)2(1)2(1). The geometry has been ob-tained from the density functional theory (DFT) method and the B3LYP method employing the 6-31G* basis sets. The calculated results propose that the latter is close to the experimental data. The structural parameters from the theory are close to those of the crystal and the calculated total energy of coordination is -31677.172 eV. The energy of HOMO and LUMO and the energy gap are 5.179 eV, -1.603 eV and 3.577 eV, respectively.  相似文献   

Monte Carlo simulation of scintillation crystal detector for formation element logging     

HAN Ruiyi  WANG Zhuwen 《世界地质(英文版)》2019,22(2):128-132

Formation elements logging is a neutron gamma spectroscopy logging technique used to acquire the content of elements and minerals by recording the gamma ray produced by the reaction of neutron and elemental nucleus in the formation. It has a wide usage in discriminating complex lithology and evaluating unconventional reservoir. The Monte Carlo simulation model of formation elements logging tool is established in this paper, with which the effects of tool parameters including the material and length of the scintillation crystal and source spacing on logging responses are modeled. The results show that the energy response of LaBr_3: Ce crystal is better than others, and the detection efficiency increases with the crystal length but decrease with source spacing. The above results may be used as a reference for optimizing the tool structure design.  相似文献