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Design of a Metasurface Antenna Based on Characteristic Mode Theory
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作者 HE Huan 《电讯技术》 北大核心 2024年第10期1561-1568,共8页
A novel metasurface antenna consisting of 5×5 rectangular patch elements is presented.Thestructure with and without the central element are both analyzed by the Characteristic Mode Theory(CMT).The developed mutua... A novel metasurface antenna consisting of 5×5 rectangular patch elements is presented.Thestructure with and without the central element are both analyzed by the Characteristic Mode Theory(CMT).The developed mutually orthogonal principal modes of the optimized periodic patch structure areexcited by a center-feed dipole.A differential feeding network is employed to realize impedance matching.Prototype with profile height of 0.07λ_(0)(λ_(0)is the wavelength in free space at the lowest operatingfrequency)is fabricated and assembled to verify the simulation results.The measured results show that thereflectance coefficient of proposed matesurface antenna is less than-10 dB in the whole operating bandrange from 4.2 GHz to 5.5 GHz,a relative bandwidth of 26.8%is achieved,and the maximummeasured realized gain is more than 9 dBi with a maximum radiation efficiency of 90%.The designprovides a guideline on the application of characteristic modes(CMs)to radiation problems. 展开更多
关键词 metasurface antenna characteristic mode theory dipole antenna realized gain
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Why the abnormal phenomena of D-band center theory exist?A new BASED theory for surface catalysis and chemistry
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作者 Zelong Qiao Run Jiang +1 位作者 Jimmy Yun Dapeng Cao 《Chinese Journal of Catalysis》 SCIE CAS CSCD 2024年第9期44-53,共10页
Since the D-band center theory was proposed,it has been widely used in the fields of surface chemistry by almost all researchers,due to its easy understanding,convenient operation and relative accuracy.However,with th... Since the D-band center theory was proposed,it has been widely used in the fields of surface chemistry by almost all researchers,due to its easy understanding,convenient operation and relative accuracy.However,with the continuous development of material systems and modification strategies,researchers have gradually found that D-band center theory is usually effective for large metal particle systems,but for small metal particle systems or semiconductors,such as single atom systems,the opposite conclusion to the D-band center theory is often obtained.To solve the issue above,here we propose a bonding and anti-bonding orbitals stable electron intensity difference(BASED)theory for surface chemistry.The newly-proposed BASED theory can not only successfully explain the abnormal phenomena of D-band center theory,but also exhibits a higher accuracy for prediction of adsorption energy and bond length of intermediates on active sites.Importantly,a new phenomenon of the spin transition state in the adsorption process is observed based on the BASED theory,where the active center atom usually yields an unstable high spin transition state to enhance its adsorption capability in the adsorption process of intermediates when their distance is about 2.5Å.In short,the BASED theory can be considered as a general principle to understand catalytic mechanism of intermediates on surfaces. 展开更多
关键词 Surface chemistry Surface catalysis D-band center theory Bonding orbital Anti-bonding orbital
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Theoretical expressions of thermal conductivity of wood 被引量:8
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作者 杨庆贤 《Journal of Forestry Research》 SCIE CAS CSCD 2001年第1期43-46,共5页
In this paper, the theoretical expressions of wood thermal conductiv ity in the choral and radical direction are derived from the micro-structure of wood by applying some basic principles in physical mechanics. The t... In this paper, the theoretical expressions of wood thermal conductiv ity in the choral and radical direction are derived from the micro-structure of wood by applying some basic principles in physical mechanics. The thermal conduc tivities of about twenty species of trees were calculated by means of the expres sions and compared with its experimental values under the same condition. The av erage relative error is about 5%, so the calculation result is satisfactory. 展开更多
关键词 Thermal conductivity WOOD Choral direction Radical direction Theor etical expression
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IMPROVEMENT OF MATRIX REPRESENTATION METHOD IN NORMAL FORM THEORY 被引量:1
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作者 韩景龙 《Transactions of Nanjing University of Aeronautics and Astronautics》 EI 2002年第2期166-171,共6页
In this paper, based on the invariant subspace theory and adjoint operator concept of linear operator, a new matrix representation method is proposed to calculate the normal forms of n order general nonlinear dyna... In this paper, based on the invariant subspace theory and adjoint operator concept of linear operator, a new matrix representation method is proposed to calculate the normal forms of n order general nonlinear dynamic systems. In the method, there is no need to determine the structure of the class of normal forms in advance. Because the subspace is not related to the dimensions of the system and the order of the normal forms directly, it is determined only by a given vector field. So the normal forms with high orders and dimensions can be calculated by the method without difficulties. In this paper, is used the method for selecting the minimal subspace and solving homological equations in the subspace, the examples show that the method is very effective. 展开更多
关键词 dynamic system normal forms NONLINEARITY linear space adjoint operator
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The theoretical expressions of wood thermal diffusivity
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作者 杨庆贤 杨绮 《Journal of Forestry Research》 SCIE CAS CSCD 2001年第2期133-135,共3页
From viewpoint of chemical element and microstructure of wood, this paper makes a discussion on thermal diffusivity of wood and two theoretical expressions of thermal diffusivity for the choral and radial directions w... From viewpoint of chemical element and microstructure of wood, this paper makes a discussion on thermal diffusivity of wood and two theoretical expressions of thermal diffusivity for the choral and radial directions were derived. The thermal diffusivities of the choral and radial directions for about 20 species of trees were calculated with the derived theoretical expressions and compared with the experimental values. The average error of the theoretical values of thermal diffusivity was 7.5% for choral direction and 6.2% for radial direction. 展开更多
关键词 Thermal diffusivity Theoretical expression WOOD
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Surface-enhanced Raman Scattering of Aflatoxin B1 on Silver by DFT Method
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作者 高思敏 王红艳 林月霞 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 2014年第2期131-136,I0003,共7页
The structure, electrostatic properties, and Raman spectra of aflatoxin B1 (AFB1) and AFB1-Ag complex are studied by density functional theory with B3LYP/6- 311G(d,p)/Lan12dz basis set. The results show that the s... The structure, electrostatic properties, and Raman spectra of aflatoxin B1 (AFB1) and AFB1-Ag complex are studied by density functional theory with B3LYP/6- 311G(d,p)/Lan12dz basis set. The results show that the surface-enhanced Raman scattering (SERS) and pre-resonance Raman spectra of AFB1-Ag complex strongly depend on the adsorption site and the excitation wavelength found to enhance 102-103 order compared to of the incident light. The SERS factors are normal Raman spectrum of AFB1 molecule due to the larger static polarizabilities of the AFB1-Ag complex, which directly results in the stronger chemical enhancement in SERS spectra. The pre-resonance Raman spectra of AFB1-Ag complex are explored at 266, 482, 785, and 1064 nm incident light wavelength, in which the enhancement factors are about 10^2-10^4, mainly caused by the charge-transfer excitation resonance. The vibrational modes are analyzed to explain the relationship between the vibrational direction and the enhanced Raman intensities. 展开更多
关键词 Aflatoxin B1 Surface-enhanced Raman scattering spectrum Pre-resonanceRaman spectra Density functional theory
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'The Theory of Field-Effect Transistors XII.The Bipolar Drift and Diffusion Currents(1-2-MOS-Gates on Thin-Thick Pure-Impure Base)
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作者 揭斌斌 薩支唐 《Journal of Semiconductors》 EI CAS CSCD 北大核心 2008年第7期1227-1241,共15页
The previous report (XI) gave the electrochemical-potential theory of the Bipolar Field-Effect Transistors. This report (XII) gives the drift-diffusion theory. Both treat 1-gate and 2-gate, pure-base and impure-ba... The previous report (XI) gave the electrochemical-potential theory of the Bipolar Field-Effect Transistors. This report (XII) gives the drift-diffusion theory. Both treat 1-gate and 2-gate, pure-base and impure-base, and thin and thick base. Both utilize the surface and bulk potentials as the parametric variables to couple the voltage and current equations. In the present drift-diffusion theory, the very many current terms are identified by their mobility multiplier for the components of drift current,and the diffusivity multiplier for the components of the diffusion current. Complete analytical driftdiffusion equations are presented to give the DC current-voltage characteristics of four common MOS transistor structures. The drift current consists of four terms: 1-D (One-Dimensional) bulk charge drift term, 1-D carrier space-charge drift term,l-D Ex^2 (transverse electric field) drift term,2-D drift term. The diffusion current consists of three terms: 1-D bulk charge diffusion term,l-D carrier space-charge diffusion term,and 2-D diffusion term. The 1-D Ex^2 drift term was missed by all the existing transistor theories, and contributes significantly, as much as 25 % of the total current when the base layer is nearly pure. The 2-D terms come from longitudinal gradient of the longitudinal electric field,which scales as the square of the Debye to Channel length ratio, at 25nm channel length with nearly pure base, (LD/L)^2 = 10^6 but with impurity concentration of 10^18cm^-3 , (LD/L)^2 = 10^-2 . 展开更多
关键词 bipolar field-effect transistor theory surface potential drift and diffusion theory single-gate impure-base double-gate impure-base
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齿轮耦合的转子-轴承系统非线性动力特性的研究 被引量:31
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作者 张锁怀 李忆平 丘大谋 《机械工程学报》 EI CAS CSCD 北大核心 2001年第9期53-57,61,共6页
在考虑齿轮时变啮合刚度、齿侧间隙、脱齿、挤齿及齿背接触 等因素的情况下,建立了齿轮耦合的转子—滑动轴承系统的多自由度动力学模型。用数值方 法研究了该系统的质量不平衡响应,结果发现,由于齿轮时变啮合刚度的影响,随着转速的... 在考虑齿轮时变啮合刚度、齿侧间隙、脱齿、挤齿及齿背接触 等因素的情况下,建立了齿轮耦合的转子—滑动轴承系统的多自由度动力学模型。用数值方 法研究了该系统的质量不平衡响应,结果发现,由于齿轮时变啮合刚度的影响,随着转速的 增加,系统动力学响应首先由周期运动向准周期运动变化,当转速超过某一值时,系统的响应将由准周期运动发展为混沌运动;由于混沌运动,转子将沿齿轮中心线方向产生很大的变 形,脱齿、齿背接触及挤齿现象也将发生,可能导致系统产生破坏。 展开更多
关键词 齿侧间隙 时变啮合刚度 分岔 混沌 非线性动力学 齿轮耦合 转子-轴承系统
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Pancreatic Head Carcinoma Versus Chronic Pancreatitis of Pancreatic Head: MR Imaging
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作者 夏黎明 杨敏洁 《The Chinese-German Journal of Clinical Oncology》 CAS 2005年第1期16-20,66,共6页
Objective: To evaluate the manifestation of pancreatic head carcinoma andchronic pancreatitis of pancreatic head on magnetic resonance (MR) imaging and to determine whetherMR imaging can distinguish the two diseases. ... Objective: To evaluate the manifestation of pancreatic head carcinoma andchronic pancreatitis of pancreatic head on magnetic resonance (MR) imaging and to determine whetherMR imaging can distinguish the two diseases. Methods: A retrospective review of MR findings wasperformed for 24 patients with pancreatic head carcinoma and 3 patients with chronic pancreatitis ofpancreatic head. SE T1WI and FSE T2WI sequences with and without fat suppression were performed onall 27 cases. Enhanced SE T1WI with fat suppression was performed on 8 patients with carcinomas and3 patients with pancreatitis, respectively. When dilatation of the pancreatic and/or biliary ductswas noted on T2WI sequence, MRCP were performed on 23 patients with carcinoma and 1 patient withpancreatitis, respectively. Results: Cases of carcinoma presented hypointensity (n=8) or mildhypointensity (n=16) on conventional SE T1WI, hy-perintensity (n=8), mild hyperintensity (n=5),isointensity (n=10) or hypointensity (n=1) on conventional FSE T2WI,hyperintensity (n=11),isointensity (n=11) or mild hypointensity (n=2) on FSE T2WI with fat suppression, and hypointensity(n=24) on fat-suppressed SE T1WI. MRCP demonstrated typical 'double duct sign' and abruptinterruption at distal segment of dilated common bile duct. All 8 patients with carcinoma showedlittle enhancement. All 3 patients with chronic pancreatitis showed mild hypointensity oriosintensity on conventional SE T1WI and hyperintensity on conventional FSE T2WI sequences,respectively. Two patients showed isointensity and mild hyperintensity on fat-suppressed SE T1WI andFSE T2WI sequences, respectively. The remaining patient showed hypointensity and heterogeneousintensity on fat-suppressed SE T1WI and FSE T2WI sequences respectively and a mild dilated commonbiliary duct with irregularly dilated proximal pancreatic duct on MRCP. All 3 patients with chronicpancreatitis showed various enhancements. Conclusion: Both pancreatic head carcinoma and chronicpancreatitis show various signals on various sequences and abnormal pancreatic enhancement patternand most cases of pancreatic head carcinoma and some cases of chronic pancreatitis show abnormalMRCP appearances. With the combined use of multiple sequences, especially precontrast andpostcontrast SE T1WI FS and MRCP, pancreatic head carcinoma and chronic pancreatitis of pancreatichead may be distinguished from each other. 展开更多
关键词 PANCREAS magnetic resonance imaging pancreas neoplasms PANCREATITIS
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Role of Tissue Factor Pathway Inhibitor-2 in Ovarian Tumor Migration and Invasion 被引量:2
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作者 仲任 黄瑞滨 宋善俊 《The Chinese-German Journal of Clinical Oncology》 CAS 2005年第1期53-55,68-69,共5页
Objective: To elucidate the relation between human tissue factor pathwayinhibitor-2 (TFPI-2) expression and ovarian tumor migration and invasion. Methods: Human TFPI-2expression vector pBos-Cite-neo/TFPI-2 was transfe... Objective: To elucidate the relation between human tissue factor pathwayinhibitor-2 (TFPI-2) expression and ovarian tumor migration and invasion. Methods: Human TFPI-2expression vector pBos-Cite-neo/TFPI-2 was transfected into ovarian tumor cells line A2780- Afterthe transfected cells were selected by G418, transfected and nontransfected cells were screened forTFPI-2 mRNA and protein by reverse transcription-polymerase chain reaction and Western blotanalysis, respectively. The number of transfected or nontransfected cells passing through membraneof Boyden chamber was counted as the basis assessing tumor cells migratory and invasive behaviors.Results: Expression of mRNA and protein of TFPI-2 was detectable in transfected cells. In invasionassay, the number of TFPI-2-expressing cells to traverse a Matrigel-coated membrane was obviouslydecreased compared with that of nonexpressing cells (59.3±6.5 vs 109.7±5.5, P 【 0.01); While inmigration assay, no significant difference through a noncoated membrane was observed amongtransfected and nontransfected cells (114.7±8.6 vs 127.3±7.1, P 】 0.05). Conclusion: Expression ofTFPI-2 may strongly inhibit the invasive ability of ovarian tumor cells in vitro, but has no effecton the migratory ability which provides an experimental basis for genotherapy of human ovariantumor. 展开更多
关键词 tissue factor pathway inhibitor-2 ovarian tumor INVASION MIGRATION
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Knowledge presentation model for QnA web forums
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作者 于士涛 袁晓洁 师建兴 《Journal of Southeast University(English Edition)》 EI CAS 2007年第3期369-372,共4页
For an extract description of threads information in question and answer (QnA) web forums, it is proposed to construct a QnA knowledge presentation model in the English language, and then an entire solution for the ... For an extract description of threads information in question and answer (QnA) web forums, it is proposed to construct a QnA knowledge presentation model in the English language, and then an entire solution for the QnA knowledge system is presented, including data gathering, platform building and applications design. With pre-defined dictionary and grammatical analysis, the model draws semantic information, grammatical information and knowledge confidence into IR methods, in the form of statement sets and term sets with semantic links. Theoretical analysis shows that the statement model can provide an exact presentation for QnA knowledge, breaking through any limits from original QnA patterns and being adaptable to various query demands; the semantic links between terms can assist the statement model, in terms of deducing new from existing knowledge. The model makes use of both information retrieval (IR) and natural language processing (NLP) features, strengthening the knowledge presentation ability. Many knowledge-based applications built upon this model can be improved, providing better performance. 展开更多
关键词 QnA web forum knowledge presentation semantic link statement model knowledge confidence
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Thesaurus-based approach for building domain ontology with a case study of military aircraft prototype ontology construction 被引量:3
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作者 真溱 唐爱民 +1 位作者 沈钧毅 卢胜军 《Journal of Southeast University(English Edition)》 EI CAS 2006年第3期353-356,共4页
To alleviate the amount of work involved in constructing a domain ontology, starting with the base of an existing terminological-rich thesaurus is better than starting from scratch. With a case study of reengineering ... To alleviate the amount of work involved in constructing a domain ontology, starting with the base of an existing terminological-rich thesaurus is better than starting from scratch. With a case study of reengineering the Defense Science and Technology Thesaurus into a prototype military aircraft ontology, a four-phase thesaurus-based methodology is introduced and investigated, which consists of identifying the application purpose, overall design, designing in detail and evaluation. Designing in detail is the core step, converting the terms and semantic relationships of the thesaurus into an ontology and supplementing richer semantic relationships. The resulting prototype ontology includes 87 concepts and 34 relationships, and can be extended and scaled up to a full-fledged domain ontology in the future. Eight universal genres of relationships of this ontology are preliminarily summarized and analyzed, including equivalent relationships, approximate relationships, generic/abstract relationships, part/whole relationships, cause/effect relationships, entity/location relationships etc., and the normalization of semantic relationships is critical to the merging and reusing of follow-up multiple ontologies. 展开更多
关键词 THESAURUS domain ontology CONSTRUCTION METHODOLOGY semantic relationship
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Representation Theory of Three-Dimensional Elliptical Crack Under Dynamic Loading
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作者 范天佑 《Journal of Beijing Institute of Technology》 EI CAS 2000年第2期138-141,共4页
The relation between the normal displacement on the surface of a dynamical elliptical crack and the normal stress over the crack surface was studied. The three dimensional elastodynamic equations and Fourier Laplace... The relation between the normal displacement on the surface of a dynamical elliptical crack and the normal stress over the crack surface was studied. The three dimensional elastodynamic equations and Fourier Laplace transforms are used. Based on the influence function and the inversion of integral transforms, one can find that if the distribution of normal displacement on the surface of a dynamic elliptical crack is a polynomial of degree n in x 1 and x 2 , then the normal pressure acting over the ellipse is also a polynomial P n(x 1,x 2) of the same degree in x 1 and x 2 . 展开更多
关键词 dynamic elliptical crack ELASTODYNAMICS integral transforms representation theory
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Vector modeling of robotic helical milling hole movement and theoretical analysis on roughness of hole surface 被引量:2
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作者 SHAN Yi-cai HE Ning +2 位作者 LI Liang ZHAO Wei YANG Yin-fei 《Journal of Central South University》 SCIE EI CAS 2013年第7期1818-1824,共7页
To avoid the machine problems of excessive axial force, complex process flow and frequent tool changing during robotic drilling holes, a new hole-making technology (i.e., helical milling hole) was introduced for desig... To avoid the machine problems of excessive axial force, complex process flow and frequent tool changing during robotic drilling holes, a new hole-making technology (i.e., helical milling hole) was introduced for designing a new robotic helical milling hole system, which could further improve robotic hole-making ability in airplane digital assembly. After analysis on the characteristics of helical milling hole, advantages and limitations of two typical robotic helical milling hole systems were summarized. Then, vector model of helical milling hole movement was built on vector analysis method. Finally, surface roughness calculation formula was deduced according to the movement principle of helical milling hole, then the influence of main technological parameters on surface roughness was analyzed. Analysis shows that theoretical surface roughness of hole becomes poor with the increase of tool speed ratio and revolution radius. Meanwhile, the roughness decreases according to the increase of tool teeth number. The research contributes greatly to the construction of roughness prediction model in helical milling hole. 展开更多
关键词 helical milling hole robotic hole-making system vector modeling theoretical surface roughness
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Wave Trapping by Dual Porous Barriers Near a Wall in the Presence of Bottom Undulation 被引量:1
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作者 R.B. Kaligatla Manisha T. Sahoo 《Journal of Marine Science and Application》 CSCD 2017年第3期286-297,共12页
Trapping of oblique surface gravity waves by dual porous barriers near a wall is studied in the presence of step type varying bottom bed that is connected on both sides by water of uniform depths. The porous barriers ... Trapping of oblique surface gravity waves by dual porous barriers near a wall is studied in the presence of step type varying bottom bed that is connected on both sides by water of uniform depths. The porous barriers are assumed to be fixed at a certain distance in front of a vertical rigid wall. Using linear water wave theory and Darcy's law for flow past porous structure, the physical problem is converted into a boundary value problem. Using eigenfunction expansion in the uniform bottom bed region and modified mild-slope equation in the varying bottom bed region, the mathematical problem is handled for solution. Moreover, certain jump conditions are used to account for mass conservation at slope discontinuities in the bottom bed profile. To understand the effect of dual porous barriers in creating tranquility zone and minimum load on the sea wall, reflection coefficient, wave forces acting on the barrier and the wall, and surface wave elevation are computed and analyzed for different values of depth ratio, porous-effect parameter, incident wave angle, gap between the barriers and wall and slope length of undulated bottom. The study reveals that with moderate porosity and suitable gap between barriers and sea wall, using dual barriers an effective wave trapping system can be developed which will exert less wave force on the barriers and the rigid wall. The proposed wave trapping system is likely to be of immense help for protecting various facilities/infrastructures in coastal environment. 展开更多
关键词 porous barriers mild-slope equation reflection coefficient wave trapping porous-effect parameter
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Application of response surface methodology(RSM) for optimization of leaching parameters for ash reduction from low-grade coal 被引量:12
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作者 Sushanta Kumar Behera Himanshu Meena +1 位作者 Sudipto Chakraborty B.C.Meikap 《International Journal of Mining Science and Technology》 EI CSCD 2018年第4期617-625,共9页
Coal is the world's most abundant energy source because of its abundance and relatively low cost. Due to the scarcity in the supply of high-grade coal, it is necessary to use low-.grade coal for fulfilling energy dem... Coal is the world's most abundant energy source because of its abundance and relatively low cost. Due to the scarcity in the supply of high-grade coal, it is necessary to use low-.grade coal for fulfilling energy demands of modern civilization. However, due to ItS high ash and moisture content, low-grade coal exerts the substantial impact on their consumption like pyrolysis, liquefaction, gasification and combus- tion process. The present research aimed to develop the efficient technique for the production of clean coal by optimizing the operating parameters with the help of response surface methodology. The effect of three independent variables such as hydrofluoric acid (HF) concentration (10-20% by vo!ume ),. temper- ature (60-100 ~C), and time (90-180 min), for ash reduction from the low-grade coal was Investigated.. A quadratic model was proposed to correlate the independent variables for maximum ash reduction at the optimum process condition by using central composite design (CC.D)method. The study reveals that HF concentration was the most effective parameter for ash reduction in comparison with time and temper- ature. It may be due to the higher F-statistics value for HF concentration, which effects to large extent of ash reduction. The characterization of coal was evaluated by Fourier transform infrared spectroscopy (FTIR) analysis and Field-emission scanning electron microscopy with energy-dispersive X-ray (FESEM- EDX) analysis for confirmation of the ash reduction. 展开更多
关键词 Low-grade coal Hydrofluoric acid (HF)Leaching Ash reduction Response surface methodology
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A method for predicting critical load evaluating adhesion of coatings in scratch testing 被引量:1
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作者 陈溪芳 严密 +1 位作者 杨德人 HIROSEYukio 《Journal of Zhejiang University Science》 CSCD 2003年第6期709-713,共5页
In this paper based on the experiment principle of evaluating adhesion property by scratch testing, the peeling mechanism of thin films is discussed by applying contact theory and surface physics theory. A mathematica... In this paper based on the experiment principle of evaluating adhesion property by scratch testing, the peeling mechanism of thin films is discussed by applying contact theory and surface physics theory. A mathematical model predicting the critical load is proposed for calculating critical load as determined byscratch testing. The factors for correctly evaluating adhesion of coatings according to the experimental data arediscussed. 展开更多
关键词 COATING ADHESION Scratch testing Critical load prediction
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Recent advances in micro-alloyed wrought magnesium alloys:Theory and design 被引量:12
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作者 Bin JIANG Zhi-hua DONG +2 位作者 Ang ZHANG Jiang-feng SONG Fu-sheng PAN 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2022年第6期1741-1780,共40页
Micro-alloying design of wrought magnesium(Mg) alloys is an important strategy to achieve high mechanical properties at a low cost. In the last two decades, significant progress has been made from both theory and expe... Micro-alloying design of wrought magnesium(Mg) alloys is an important strategy to achieve high mechanical properties at a low cost. In the last two decades, significant progress has been made from both theory and experiment. In the present review, we try to summarize recent advances in micro-alloying design of wrought Mg alloys from both theoretical and pragmatic perspectives, and provide fundamental data required for establishing the relationship between chemical composition and mechanical properties of Mg alloys. We start with theoretical attempts for understanding the mechanical properties of Mg alloys at different scales, by involving first principle calculations,molecular dynamics, cellular automata, and crystal plasticity. Then, the role of alloying elements is discussed for a series of promising Mg alloys such as Mg-Al, Mg-Zn, Mg-RE(rare-earth element), Mg-Sn, and Mg-Ca families.Potential challenges in the micro-alloying design of Mg alloys are highlighted at the end. The review is expected to provide helpful guidance for the intelligent design of novel wrought Mg alloys and inspire more innovative ideas in this field. 展开更多
关键词 magnesium alloys alloying design mechanical properties theoretical calculations experimental characterizations
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A DFT+U study of the structures and reactivities of polar CeO_2(100) surfaces
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作者 钟素红 卢冠忠 龚学庆 《Chinese Journal of Catalysis》 CSCD 北大核心 2017年第7期1138-1147,共10页
Density functional theory calculations corrected by on-site Coulomb interactions were carried out o study the structures of polar CeO2 (100) surfaces as well as activities during catalytic CO oxidation. The stabilit... Density functional theory calculations corrected by on-site Coulomb interactions were carried out o study the structures of polar CeO2 (100) surfaces as well as activities during catalytic CO oxidation. The stabilities of various CeO2 (100) termination structures are discussed, and calculated energetics are presented. The most stable Ce〇2 (100) surface was obtained by removing half the outermost full layer of oxygen and the surface stability was found to decrease as the exposed oxygen concentration was increased. Assessing the reaction pathways leading to different final products during CO oxidation over the most stable CeO2 (100) surface, we determined that the formation of carbonate species competed with CO2 desorption. However, during CO oxidation on the less stable CeO2 (100) surfaces having more exposed oxygen, the CO is evidently able to react with surface oxygen, leading to CO2 formation and desorption. The calculation results and electronic analyses reported herein also indicate that the characteristic Ce 4/ orbitals are directly involved in deter-mining the surface stabilities and reactivities. 展开更多
关键词 Cerium dioxide(100) Density functional theory calculations corrected by on-site Coulomb interactions Polar surface Carbon monoxide oxidation Electron localization
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Development of a New Index for Integrating Landscape Patterns with Ecological Processes at Watershed Scale 被引量:42
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作者 CHEN Liding TIAN Huiying +1 位作者 FU Bojie ZHAO Xinfeng 《Chinese Geographical Science》 SCIE CSCD 2009年第1期37-45,共9页
Understanding the relationship between landscape pattems and ecological processes has been a central yet challenging research theme in landscape ecology. Over the past decades, many landscape metrics have been propose... Understanding the relationship between landscape pattems and ecological processes has been a central yet challenging research theme in landscape ecology. Over the past decades, many landscape metrics have been proposed but few directly incorporated ecological processes. In this paper, we developed a landscape index, namely, location-weighted landscape index (LWLI) to highlight the role of landscape type in ecological processes, such as nutrient losses and soil erosion. Within the framework of the Lorenz curve theory, we develop this index by integrating land- scape pattern and point-based measurements at a watershed scale. The index can be used to characterize the contribution of landscape pattern to ecological processes (e.g. nutrient losses) with respect to a specific monitoring point in a watershed. Through a case study on nutrient losses in an agricultural area in northeastern China, we found that nutrient losses tended to be higher for a watershed with a higher LWLI value, and vice versa. It implied that LWLI can be used to evaluate the potential risk of nutrient losses or soil erosion by comparing their values across watersheds. In addition, this index can be extended to characterize ecological processes, such as the effect of landscape pattern on wildlife inhabitation and urban heat island effect. Finally, we discuss several problems that should be paid attention to when applying this index to a heterogeneous landscape site. 展开更多
关键词 landscape pattern location-weighted landscape index (LWLI) Lorenz curve theory nutrient loss surface water quality
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