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基于次序统计量的4鸭问题求解
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作者 杨筱菡 钱伟民 周叶青 《大学数学》 2024年第3期91-94,共4页
次序统计量是数理统计基本概念章节的一个教学难点.通过4鸭问题,介绍次序统计量解决该问题的一种解题思路,融入次序统计量概率密度函数的梳理,为次序统计量内容的讲授丰富教学思路.
关键词 次序统计量 联合密度函数 4鸭问题
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镁含量对Ni/MgAl_(2)O_(4)催化剂甲烷干重整反应性能的影响 被引量:1
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作者 吕帅帅 徐成 +9 位作者 张荣俊 李红伟 刘英硕 文富利 侯朝鹏 孙霞 汪天也 吴玉 徐润 夏国富 《燃料化学学报(中英文)》 EI CAS CSCD 北大核心 2024年第3期313-322,共10页
本研究采用溶剂蒸发自组装法制备了不同Mg含量的镁铝尖晶石(MgAl_(2)O_(4))载体,随后负载了金属Ni,并将该催化剂(Ni/x-MAO)应用于甲烷干重整制合成气反应。结合X射线衍射、氮气物理吸附-脱附和透射电镜等表征对催化剂的结构性质进行了分... 本研究采用溶剂蒸发自组装法制备了不同Mg含量的镁铝尖晶石(MgAl_(2)O_(4))载体,随后负载了金属Ni,并将该催化剂(Ni/x-MAO)应用于甲烷干重整制合成气反应。结合X射线衍射、氮气物理吸附-脱附和透射电镜等表征对催化剂的结构性质进行了分析,发现适量Mg的加入(10%-15%)有利于提高载体的比表面积,并形成耐高温的有序介孔结构。该结构可以将Ni颗粒限域在孔道内,有利于形成高分散、小晶粒的活性物种,其在高温反应下不易烧结。同时,H2-TPR和XPS结果表明,10%-15%的Mg含量有利于增强Ni与MgAl_(2)O_(4)的金属-载体相互作用,有效抑制Ni烧结,且其表面的活性氧物种有效抑制了积炭生成。在性能评价中,10%-15%Mg含量的Ni/MgAl_(2)O_(4)催化剂呈现出优异的CH4和CO_(2)转化率,在180 h的长周期活性评价期间,Ni/15-MAO催化剂的CH4和CO_(2)转化率分别保持在92.6%和92.5%左右,同时积炭量仅为0.89%,且反应后的Ni颗粒尺寸变化不大。 展开更多
关键词 甲烷干重整反应 有序介孔MgAl_(2)O_(4) 镍基催化剂
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Enhanced activation of peroxymonosulfate by Fe/N co-doped ordered mesoporous carbon with dual active sites for efficient removal of m-cresol
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作者 Donghui Li Wenzhe Wu +6 位作者 Xue Ren Xixi Zhao Hongbing Song Meng Xiao Quanhong Zhu Hengjun Gai Tingting Huang 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2024年第1期130-144,共15页
The novel Fe-N co-doped ordered mesoporous carbon with high catalytic activity in m-cresol removal was prepared by urea-assisted impregnation and simple pyrolysis method.During the preparation of the Fe-NC catalyst,th... The novel Fe-N co-doped ordered mesoporous carbon with high catalytic activity in m-cresol removal was prepared by urea-assisted impregnation and simple pyrolysis method.During the preparation of the Fe-NC catalyst,the complexation of N elements in urea could anchor Fe,and the formation of C3N4during urea pyrolysis could also prevent migration and aggregation of Fe species,which jointly improve the dispersion and stability of Fe.The FeN4sites and highly dispersed Fe nanoparticles synergistically trigger the dual-site peroxymonosulfate (PMS) activation for highly efficient m-cresol degradation,while the ordered mesoporous structure of the catalyst could improve the mass transfer rate of the catalytic process,which together promote catalytic degradation of m-cresol by PMS activation.Reactive oxygen species (ROS) analytic experiments demonstrate that the system degrades m-cresol by free radical pathway mainly based on SO_(4)^(-)·and·OH,and partially based on·OH as the active components,and a possible PMS activation mechanism by 5Fe-50 for m-cresol degradation was proposed.This study can provide theoretical guidance for the preparation of efficient and stable catalysts for the degradation of organic pollutants by activated PMS. 展开更多
关键词 Degradation PEROXYMONOSULFATE Fe(II)/Fe(III)/FeN4 ordered mesopores carbon Catalyst Radical
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可控合成具有增强光催化性能的CeO_(2)纳米中空球/g-C_(3)N_(4)纳米复合材料
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作者 刘玉娇 李英萍 +3 位作者 符袅 王霞 白茜茜 何洁丽 《现代化工》 CAS CSCD 北大核心 2024年第5期135-141,共7页
以Ce(NO_(3))_(3))·6H_(2))O和三聚氰胺为原料,采用简单的原位聚苯乙烯球模板法成功合成了一种新型CeO_(2)纳米中空球/g-C_(3)N_(4)纳米复合材料。将其用于紫外光催化降解对硝基苯胺(PNA)。结果表明,当CeO_(2)的复合质量分数为2.5%... 以Ce(NO_(3))_(3))·6H_(2))O和三聚氰胺为原料,采用简单的原位聚苯乙烯球模板法成功合成了一种新型CeO_(2)纳米中空球/g-C_(3)N_(4)纳米复合材料。将其用于紫外光催化降解对硝基苯胺(PNA)。结果表明,当CeO_(2)的复合质量分数为2.5%时,PNA降解效率达到90.26%。动力学拟合结果表明,PNA光催化降解过程符合拟一级反应动力学特征。与g-C_(3)N_(4)(k=0.0060 min^(-1))和CeO_(2)(k=0.0023 min^(-1))相比,CeO_(2)纳米中空球/g-C_(3)N_(4)复合材料光催化降解PNA的反应速率常数(k=0.0110 min^(-1))分别提高了1.8倍和4.8倍。CeO_(2)和g-C_(3)N_(4)复合后形成的异质结构促进了光生载流子的分离,延长了光生载流子的寿命,从而显著提高了光催化性能。 展开更多
关键词 CeO_(2)纳米球 g-C_(3)N_(4) 光催化降解 对硝基苯胺 一级反应动力学
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Synthesis of a new ordered mesoporous NiMoO_4 complex oxide and its efficient catalytic performance for oxidative dehydrogenation of propane 被引量:7
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作者 Xiaoqiang Fan Jianmei Li +4 位作者 Zhen Zhao Yuechang Wei Jian Liu Aijun Duan Guiyuan Jiang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2014年第2期171-178,共8页
Highly ordered mesoporous NiMoO4 material was successfully synthesized using mesoporous silica KIT-6 as hard template via vacuum nanocasting method. The structure was characterized by means of XRD, TEM, N2 adsorption-... Highly ordered mesoporous NiMoO4 material was successfully synthesized using mesoporous silica KIT-6 as hard template via vacuum nanocasting method. The structure was characterized by means of XRD, TEM, N2 adsorption-desorption, Raman and FT-IR. The mesoporous NiMoO4 with the coexistence of a-NiMoO4 and fl-NiMoO4 showed well-ordered mesoporous structure, a bimodal pore size distribution and crystalline framework. The catalytic performance of NiMoOa was investigated for oxidative dehydrogenation of propane. It is demonstrated that the mesoporous NiMoO4 catalyst with more surface active oxygen species showed better catalytic performance in oxidative dehydrogena- tion of propane in comparison with bulk NiMoO4. 展开更多
关键词 ----w 7ordered mesoporous structure NiMoO4 complex oxide vacuum nanocasting PROPANE oxidative dehydrogenation
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Existence of solutions of nonlinear two-point boundary value problems for 4nth-order nonlinear differential equation 被引量:3
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作者 GAO Yong-xin(高永馨) 《Journal of Harbin Institute of Technology(New Series)》 EI CAS 2002年第4期424-428,共5页
Studies the existence of solutions of nonlinear two point boundary value problems for nonlinear 4n-th-order differential equationy (4n)=f(t,y,y′,y″,...,y (4n-1))(a)with the boundary conditions g 2i(y (2i)(a),y (2i+1... Studies the existence of solutions of nonlinear two point boundary value problems for nonlinear 4n-th-order differential equationy (4n)=f(t,y,y′,y″,...,y (4n-1))(a)with the boundary conditions g 2i(y (2i)(a),y (2i+1)(a))=0,h 2i(y (2i)(c),y (2i+1)(c))=0,(i=0,1,...,2n-1)(b) where the functions f, g i and h i are continuous with certain monotone properties. For the boundary value problems of nonlinear nth order differential equationy (n)=f(t,y,y′,y″,...,y (n-1))many results have been given at the present time. But the existence of solutions of boundary value problem (a),(b) studied in this paper has not been covered by the above researches. Moreover, the corollary of the important theorem in this paper, i.e. existence of solutions of the boundary value problem.y (4n)=f(t,y,y′,y″,...,y (4n-1)) a 2iy (2i)(a)+a 2i+1y (2i+1)(a)=b 2i,c 2iy (2i)(c)+c 2i+1y (2i+1)(c)=d 2i,(i=0,1,...2n-1)has not been dealt with in previous works. 展开更多
关键词 NONLINEAR 4n-th order DIFFERENTIAL EQUATION NONLINEAR two point BOUNDARY VALUE problems EXISTENCE of solutions
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Effect of Ordering on Embrittlement of Ni4Mo Alloy in Hydrogen Gas 被引量:2
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作者 程晓英 李慧改 《Journal of Shanghai University(English Edition)》 CAS 2005年第6期544-549,共6页
The fracture behavior of disordered and ordered Ni4Mo alloy was investigated by tensile tests in hydrogen gas or during hydrogen charging. The results show that the ductility of the disordered alloy decreased slightly... The fracture behavior of disordered and ordered Ni4Mo alloy was investigated by tensile tests in hydrogen gas or during hydrogen charging. The results show that the ductility of the disordered alloy decreased slightly with the hydrogen pressure increasing, while that of the ordered alloy decreased rapidly with the hydrogen pressure increasing. However, the ductility of both disordered and ordered alloys reduced similarly seriously with the charging current density increasing. Therefore, the mechanism of order-induced embrittlement of Ni4 Mo alloy in hydrogen gas is supposed to be that atomic order accelerates the kinetics of the catalytic reaction for the dissociation of molecular H2 into atomic H. 展开更多
关键词 Ni4Mo alloy hydrogen embrittlement order DISorder hydrogen gas hydrogen charging.
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Explicit High-Order Method to Solve Coupled Nonlinear Schrödinger Equations
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作者 Khadijah Alamoudi Mohmmad Said Hammoudeh 《Advances in Pure Mathematics》 2021年第5期472-482,共11页
Models of the coupled nonlinear Schr<span style="white-space:nowrap;">&#246;</span>dinger equations submit various critical physical phenomena with a typical equation for optical fibres with ... Models of the coupled nonlinear Schr<span style="white-space:nowrap;">&#246;</span>dinger equations submit various critical physical phenomena with a typical equation for optical fibres with linear refraction. In this article, we will presuppose the Compact Finite Difference method with Runge-Kutta of order 4 (explicit) method, which is sixth-order and fourth-order in space and time respectively, to solve coupled nonlinear Schr<span style="white-space:nowrap;">&#246;</span>dinger equations. Many methods used to solve coupled nonlinear Schr<span style="white-space:nowrap;">&#246;</span>dinger equations are second order in time and need to use extra-technique to rise up to fourth-order as Richardson Extrapolation technique. The scheme obtained is immediately fourth-order in one step. This approach is a conditionally stable method. The conserved quantities and the exact single soliton solution indicate the competence and accuracy of the article’s suggestion schemes. Furthermore, the article discusses the two solitons interaction dynamics. 展开更多
关键词 Coupled Nonlinear Schrodinger Equations Sixth order Method Interaction of Two Solitons Compact Finite Difference Runge-Kutta of order 4 Method
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Eigenvalue Computation of Regular 4th Order Sturm-Liouville Problems
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作者 Ahmad Alalyani 《Applied Mathematics》 2019年第9期784-803,共20页
In this paper we present and test a numerical method for computing eigenvalues of 4th order Sturm-Liouville (SL) differential operators on finite intervals with regular boundary conditions. This method is a 4th order ... In this paper we present and test a numerical method for computing eigenvalues of 4th order Sturm-Liouville (SL) differential operators on finite intervals with regular boundary conditions. This method is a 4th order shooting method based on Magnus expansions (MG4) which use MG4 shooting as the integrator. This method is similar to the SLEUTH (Sturm-Liouville Eigenvalues Using Theta Matrices) method of Greenberg and Marletta which uses the 2nd order Pruess method (also known as the MG2 shooting method) for the integrator. This method often achieves near machine precision accuracies, and some comparisons of its performance against the well-known SLEUTH software package are presented. 展开更多
关键词 4th order STURM-LIOUVILLE PROBLEM Magnus METHODS (MG4) REGULAR BOUNDARY CONDITIONS
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Co_(3)O_(4) with ordered pore structure derived from wood vessels for efficient Hg^(0) oxidation
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作者 Xiaopeng Zhang Cheng Gao +7 位作者 Ziwei Wang Ximiao Wang Jie Cheng Xinxin Song Xiangkai Han Ning Zhang Junjiang Bao Gaohong He 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2022年第10期215-221,共7页
Catalytic oxidation of Hgo to Hg~O is an efficient way to remove Hg^(0) from coal-fired flue gas.The catalyst with ordered pore structure can lower mass transfer resistance resulting in higher Hg^(0) oxidation efficie... Catalytic oxidation of Hgo to Hg~O is an efficient way to remove Hg^(0) from coal-fired flue gas.The catalyst with ordered pore structure can lower mass transfer resistance resulting in higher Hg^(0) oxidation efficiency.Therefore,in the present work,wood vessels were used as sacrificial template to obtain Co_(3)O_(4) with ordered pore structure.SEM and BET results show that,when the mass concentrations of Co(NO_(3))_(2)·6H_(2)O was 20%,the obtained catalyst(Co_(3)O_(4) [20%Co(NO_(3))_(2)])possesses better pore structure and higher surface area.It will expose more available surface active sites and lower the mass transfer resistance.Furthermore,XPS results prove that Co_(3)O_(4) [20%Co(NO_(3))_(2)]has the highest ratio of chemisorbed oxygen which plays an important role in Hg^(0) oxidation process.These results lead to a better Hg^(0) oxidation efficiency of Co_(3)O_(4) [20%Co(NO_(3))_(2)],which is about 90%in the temperature range of 200 to 350℃,Furthermore,Co_(3)O_(4) [20%Co(NO_(3))_(2)]has a stable catalytic activity,and its Hg^(0) oxidation efficiency maintains above 90%at 250℃even after 90 h test,A probable reaction mechanism is deduced by the XPS results of the fresh,used and regenerated catalyst of Co_(3)O_(4) [20%Co(NO3)2].Chemisorbed oxygen can react with Hg^(0) forming HgO with the reduction of Co^(3+)to Co^(2)+.And lattice oxygen and gaseous oxygen can supplement the consumption of chemisorbed oxygen to oxidize Co^(2+)to Co^(3+). 展开更多
关键词 Wood vessel Elemental mercury Co_(3)O_(4) ordered porestructure
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Molecular Structure, Vibrational Analysis and First Order Hyperpolarizability of 4-Methyl-3-Nitrobenzoic Acid Using Density Functional Theory
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作者 Jyothi Prashanth Gaddam Ramesh +3 位作者 Jarupula Laxman Naik Jai Kishan Ojha Byru Venkatram Reddy Gandham Ramana Rao 《Optics and Photonics Journal》 2015年第3期91-107,共17页
The Fourier Transform Infrared (FTIR) and FT-Raman spectra of 4-methyl-3-nitrobenzoic acid have been recorded in the range 4000 - 400 cm-1 and 3500 - 50 cm-1, respectively. The optimized geometry of the molecule, its ... The Fourier Transform Infrared (FTIR) and FT-Raman spectra of 4-methyl-3-nitrobenzoic acid have been recorded in the range 4000 - 400 cm-1 and 3500 - 50 cm-1, respectively. The optimized geometry of the molecule, its vibrational frequencies along with corresponding intensities have been computed using the Density Functional Theory (DFT) employing B3LYP/6-311++G basis set. The scaled values of harmonic vibrational frequencies obtained in the computations have been compared with their experimental counter parts. The scaling factors have been refined to reproduce the frequencies with an RMS error of 11.68 cm-1 between the experimental and computed frequencies. The theoretically constructed spectra agree satisfactorily with those of experimental spectra. First order hyperpolarizability constants have also been evaluated. 展开更多
关键词 4-Methyl-3-Nitrobenzoic Acid VIBRATIONAL SPECTRA DFT First order HYPERPOLARIZABILITY
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Fourth-Order Adjoint Sensitivity Analysis of an OECD/NEA Reactor Physics Benchmark: II. Mathematical Expressions and CPU-Time Comparisons for Computing 4<sup>th</sup>-Order Sensitivities 被引量:2
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作者 Dan Gabriel Cacuci Ruixian Fang 《American Journal of Computational Mathematics》 2021年第2期133-156,共24页
This work extends to fourth-order previously published work on developing the adjoint sensitivity and uncertainty analysis of the numerical model of a <u>p</u>oly<u>e</u>thylene-<u>r</... This work extends to fourth-order previously published work on developing the adjoint sensitivity and uncertainty analysis of the numerical model of a <u>p</u>oly<u>e</u>thylene-<u>r</u>eflected <u>p</u>lutonium (acronym: PERP) OECD/NEA reactor physics benchmark. Previous works showed that the third-order sensitivities of the PERP leakage response with respect to these total microscopic cross sections are far larger than the corresponding 1<sup>st</sup>-order and 2<sup>nd</sup>-order ones, thereby having the largest impact on the uncertainties induced in the PERP benchmark’s response. This finding has motivated the development of the original 4<sup>th</sup>-order formulas presented in this work, which are valid not only for the PERP benchmark but can also be used for computing the 4<sup>th</sup>-order sensitivities of response of any nuclear system involving fissionable material and internal or external neutron sources. Subsequent works will use the adjoint-based mathematical expressions obtained in this work to compute exactly and efficiently the numerical values of the largest fourth-order sensitivities of the PERP benchmark’s response to the total microscopic cross sections, and use them for a pioneering fourth-order uncertainty analysis of the PERP benchmark’s response. 展开更多
关键词 Polyethylene-Reflected Plutonium Sphere 4th-order Adjoint Sensitivity Analysis Microscopic Total Cross Sections
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UV/PS降解水中2,4-二氯苯酚及毒性评价研究 被引量:5
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作者 陈菊香 高乃云 +4 位作者 鲁仙 王超慧 古振川 江闯 杨静 《中国环境科学》 EI CAS CSSCI CSCD 北大核心 2017年第1期162-166,共5页
比较采用PS,UV/PS 2种工艺降解2,4-DCP的去除效果、一级反应动力学;考察不同氧化剂(PS)剂量、不同初始浓度的2,4-DCP、腐殖酸条件对该光解反应速率常数的影响以及采用发光菌青海弧菌-Q67来评价2,4-DCP和光解过程中间产物溶液对生态环境... 比较采用PS,UV/PS 2种工艺降解2,4-DCP的去除效果、一级反应动力学;考察不同氧化剂(PS)剂量、不同初始浓度的2,4-DCP、腐殖酸条件对该光解反应速率常数的影响以及采用发光菌青海弧菌-Q67来评价2,4-DCP和光解过程中间产物溶液对生态环境的毒性评价.实验结果表明,单独PS工艺光解2,4-DCP去除率仅有4%,而UV/PS光解2,4-DCP去除率高达96.4%,充分说明UV/PS工艺可高效去除2,4-DCP,且其反应基本遵循拟一级反应动力学,一级反应动力学常数为35.1×10^(-3)min^(-1).UV/PS降解2,4-DCP的降解率和反应速率常数随着氧化剂(PS)的增加而增大,随着2,4-DCP初始浓度增大而降低.随着腐殖酸初始浓度的增大,有先增大后变小的过程.毒性评价实验中,随着2,4-DCP光解45min,发光菌抑制率降低,溶液对环境毒性在降低,且从长期时间规律来看,同一氧化时间溶液对发光菌相对抑制率与发光菌接触时间没有关系. 展开更多
关键词 2 4-二氯苯酚 UV/PS 动力学 拟一级 毒性评价
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一步合成聚苯胺/Fe_3O_4磁性纳米吸附剂去除Cr(Ⅵ)的应用 被引量:5
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作者 罗米娜 何雪梅 +3 位作者 陈馥 贺杰 卜涛 杨洋 《应用化工》 CAS CSCD 北大核心 2018年第9期1846-1849,共4页
采用一步加热法合成聚苯胺/Fe_3O_4磁性纳米颗粒(PANI-Fe_3O_4),处理模拟含Cr(Ⅵ)废水,探讨吸附时间和吸附温度对Cr(Ⅵ)去除效果的影响。结果表明,反应时间90 min达到吸附饱和状态,吸附温度25℃时可达到较好的吸附效果。在常温下,Cr(Ⅵ... 采用一步加热法合成聚苯胺/Fe_3O_4磁性纳米颗粒(PANI-Fe_3O_4),处理模拟含Cr(Ⅵ)废水,探讨吸附时间和吸附温度对Cr(Ⅵ)去除效果的影响。结果表明,反应时间90 min达到吸附饱和状态,吸附温度25℃时可达到较好的吸附效果。在常温下,Cr(Ⅵ)最大吸附量可达200. 2 mg/g,符合准二级动力学模型和Langmuir等温吸附模型。 展开更多
关键词 聚苯胺/Fe3O4 Cr(Ⅵ) 准二级动力学模型 Langmuir等温吸附模型
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EH-4系统中工频干扰的处理与改进 被引量:8
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作者 席振铢 龙霞 +2 位作者 董晨 王鹤 何彬 《地球物理学进展》 CSCD 北大核心 2010年第3期1105-1109,共5页
EH-4系统处理50 Hz工频干扰的方法一是在采集数据时进行硬件陷波,二是在利用标定文件标定功率谱时进行数字陷波.这两种陷波在没有工频干扰时会过度丢失有用信息,在强干扰下陷波不彻底,且没有对三次以上高次谐波进行压制.针对这两点不足... EH-4系统处理50 Hz工频干扰的方法一是在采集数据时进行硬件陷波,二是在利用标定文件标定功率谱时进行数字陷波.这两种陷波在没有工频干扰时会过度丢失有用信息,在强干扰下陷波不彻底,且没有对三次以上高次谐波进行压制.针对这两点不足,本文采用在50 Hz及其谐波影响频段范围内设置0权值的改进parzen窗加权平均法来取代IMAGEM窄带等权平均法对功率谱进行平滑估算,从而有效消除工频干扰.实例应用表明该方法简单有效,可以提高数据质量. 展开更多
关键词 EH-4系统 工频干扰 高次谐波 0权值 PARZEN窗 功率谱平滑
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7-羟基-4-甲基香豆素的二阶NLO性质对晶体结构的依赖性 被引量:5
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作者 赵波 周志华 《南京师大学报(自然科学版)》 CAS CSCD 2004年第3期53-56,共4页
 研究了7种香豆素衍生物的二阶非线性光学性质,在理论和实验上分析了7 羟基 4 甲基香豆素的二阶非线性光学性质对晶体结构的依赖性,表明这是一类热稳定性高、透光性好的化合物,分子在晶体中的趋向对二阶非线性光学响应有重要影响,改良...  研究了7种香豆素衍生物的二阶非线性光学性质,在理论和实验上分析了7 羟基 4 甲基香豆素的二阶非线性光学性质对晶体结构的依赖性,表明这是一类热稳定性高、透光性好的化合物,分子在晶体中的趋向对二阶非线性光学响应有重要影响,改良其晶体结构是提高这类材料综合性能的主要手段. 展开更多
关键词 7-羟基-4-甲基香豆素 二阶非线性光学性质 晶体结构
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CH_(4-)CO_2反应的催化反应动力学研究——反应级数的确定 被引量:1
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作者 宫丽红 沙雪清 +1 位作者 高扬 史克英 《哈尔滨师范大学自然科学学报》 CAS 2002年第3期57-59,共3页
采用 Ni/α-Al2 O3和工业 HSD-2型催化剂对甲烷—二氧化碳重整反应进行了动力学研究 ,结果表明反应中 CO的速率方程为 :RCO=k PCH4PCO2( CO2 的分压范围 :1 2 .5~ 3 0 k Pa;温度范围 :1 1 2 3~ 1 1 73 K)和 RCO=k PCH4( CO2的分压范围... 采用 Ni/α-Al2 O3和工业 HSD-2型催化剂对甲烷—二氧化碳重整反应进行了动力学研究 ,结果表明反应中 CO的速率方程为 :RCO=k PCH4PCO2( CO2 的分压范围 :1 2 .5~ 3 0 k Pa;温度范围 :1 1 2 3~ 1 1 73 K)和 RCO=k PCH4( CO2的分压范围 :3 0~ 45k Pa;温度范围 :1 1 2 3~ 1 1 73 K) 。 展开更多
关键词 CH4-CO2反应 催化反应动力学 甲烷--二氧化碳重整反应 反应级数 速率常数 分压范围 温度范围
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3-甲基-4-硝基吡啶氧中甲基对二阶非线性光学性质的作用 被引量:2
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作者 赵波 周志华 《南京师大学报(自然科学版)》 CAS CSCD 2003年第2期52-55,共4页
 研究了3-甲基4-硝基吡啶氧中甲基对二阶非线性光学性质和晶体结构的影响,用量子化学方法计算分析了标题化合物的电子和微观二阶非线性光学性质.结果表明甲基对分子内电荷转移和分子二阶非线性光学系数几乎没有影响,但它对材料的非中...  研究了3-甲基4-硝基吡啶氧中甲基对二阶非线性光学性质和晶体结构的影响,用量子化学方法计算分析了标题化合物的电子和微观二阶非线性光学性质.结果表明甲基对分子内电荷转移和分子二阶非线性光学系数几乎没有影响,但它对材料的非中心对称的晶体结构起着决定性的作用,从而成为材料呈现很强的宏观二阶非线性光学性质的决定性基团. 展开更多
关键词 3-甲基-4-硝基吡啶氧 甲基 二阶非线性光学性质 晶体结构 量子化学计算 电荷转移
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(二噻吩[3,2-b:3',2'-d]环戊烷-4-亚基)C_(60)中的分子轨道相互作用及其电子光谱和二阶非线性光学性质 被引量:2
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作者 孙秀云 封继康 +3 位作者 田维全 任爱民 葛茂发 孙家锺 《高等学校化学学报》 SCIE EI CAS CSCD 北大核心 1998年第11期1789-1793,共5页
在ZINDO方法基础上,按完全态求和(SOS)公式编制了计算分子二阶非线性光学系数β的程序.研究了(二噻吩[3,2-b:3,2-d]环戊烷-4-亚基)C60中的分子轨道相互作用,计算了该分子的电子光谱和二阶非线性... 在ZINDO方法基础上,按完全态求和(SOS)公式编制了计算分子二阶非线性光学系数β的程序.研究了(二噻吩[3,2-b:3,2-d]环戊烷-4-亚基)C60中的分子轨道相互作用,计算了该分子的电子光谱和二阶非线性光学系数β,前者与实验结果吻合较好,后者属于理论预测性质. 展开更多
关键词 碳60衍生物 二噻吩环戊烷 二阶非线性光学
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4次对称群S_4的子群个数及其证明 被引量:17
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作者 孙自行 崔方达 《阜阳师范学院学报(自然科学版)》 2005年第4期13-16,28,共5页
使用Lagrange定理及n次对称群的基本概念证明了4次对称群存在且只存在30个子群,并给出了每个子 群.其中,除去两个平凡的子群,另有9个2阶循环群;4个3阶循环群;3个4阶循环群;4个Klein4元群;4个S3(在 同构意义之下);3个8阶子群以及1个12... 使用Lagrange定理及n次对称群的基本概念证明了4次对称群存在且只存在30个子群,并给出了每个子 群.其中,除去两个平凡的子群,另有9个2阶循环群;4个3阶循环群;3个4阶循环群;4个Klein4元群;4个S3(在 同构意义之下);3个8阶子群以及1个12阶子群. 展开更多
关键词 4次对称群 子群 LAGRANGE定理 群的阶 元索的阶 循环置换
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