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1.
用消去法推求原子谱项   总被引:5,自引:1,他引:4  
提出了确定复杂组态的Slater函数和原子谱项的程序化方法。运用Pascal语言编制了计算程序,利用本程序可准确地导出等效组态s^N,p^N,d^N,f^N,g^N,h^N,i^N,k^N,l^N,m^N,n^N,o^N,q^N,r^N,t^N,u^N,v^N,w^N,x^N,y^N,z^N的L-S耦合谱项和Slater函数。迄今为止,还未见国内外文献报道过。  相似文献   

2.
本文根据置换群方法,运用C语言编制了计算程序,可快速、准确地推求等效组态s^N、p^N、d^N、f^N、…x^N、y^N、z^N的原子谱项。  相似文献   

3.
混煤氮的热解析出特性及燃料NO_x的形成规律   总被引:5,自引:0,他引:5  
混煤氮的热解析出特性及燃料NO_x的形成规律邱建荣,马毓义,曾汉才,吕焕尧,喻秋梅(华中理工大学煤燃烧国家重点实验室武汉430074)关键词:混煤,NO_x,混合比,燃烧。EMISSIONOFNITROGENCOMPOUNDSANDNO_xFORMAT?..  相似文献   

4.
四维NMR谱     
尽管3DNMR谱的分辨率有所提高,但解释较大的三维异核NMR谱时,仍存在含糊性。因此,人们希望通过增加维数进一步提高分辨率,在最近几年中出现了4DNMR谱,4DNMR谱常常是说明2DNMR谱的方法,4DNMR实验可简单地看作是由三个2DNMR实验所组成,新的4DNMR技术仍在不断地发展,已有许多将4DNMR谱应用于蛋白质及核酸研究的报道。  相似文献   

5.
TOTALCROSSSECTIONMEASUREMENTSFORELECTRONSCATTERINGONMETHANEBETWEEN1AND50eVLiTaihuaYeRuiyingYangYongCenterforRadiationPhysics...  相似文献   

6.
会议消息     
会议消息FIFTHINTERNATIONALCONGRESSONSOUNDANDVIBRATION¥UniversityofAdelaide,SouthAustraliaDec.15~1831997第五届国际声和振动会议将于1997年12月15~18...  相似文献   

7.
氮氧化合物在铜,银,镍,钯,铂面的吸附,脱附理论研究   总被引:1,自引:1,他引:0  
采用ASED-MO量子化学方法对氮(N2)和氮氧化合物(NOx)在Cu,Ag,Ni,Pd,Pt5种金属(111)面上的吸附态进行了系列研究,计算结果表明:在汽车尾气净化的催化处理过程中,当用铜,银,镍,钯,铂等金属作催化剂将NOx转化为N2时,以金属Pt为最好。用铂作催化剂将NO还原成N2时,可得如下反应机理:NO分子首先吸附在Pt表面,然后吸附分子NO的N-O键中O原子。  相似文献   

8.
三维NMR谱     
3DNMR谱是2DNMR谱附加一个时间周期扩展而成,3DNMR共振峰的重叠降低,并且灵敏度与常规的2DNOESY实验大体相当,采集3DNMR数据组所需时间太长,因此迄今为止,该方法的实际应用只局限于那些浓度相当高的样品。尽管目前还十分费时,但很可能3DNMR不久即可成为常规的NMR技术。  相似文献   

9.
采用直流-射频等离子增强化学汽相沉积技术制备a(C:H(N)薄膜,用X射互光电子能谱研究了混合气体中N2含量对薄膜成分与结构的影响,a-C:H(N)薄膜中含氮量可达9.09%,对a-C:H(N)薄膜的Nls结合能谱的分析表明a-C:H(N)薄膜的结构是由C3N4相镶嵌在sp^2键结合的Cx基体组成,其中C3N4相中N和C原子比接近4:3,不随薄膜中含N量改变,薄膜中C3N4相和sp^3碳伯含量随N  相似文献   

10.
本文提出了推求复杂组态L-S耦合谱项波函数的系统方法,着重解决了推求多重谱项的谱项波函数这一难题,运用PASCAL语言编制了计算程序,利用本程序可快速、准确地求出等效组态的s^N,p^N,d^N,g^N,i^N,k^N的L-S耦合谱项和谱项波函数  相似文献   

11.
A time domain finite volume method(TDFVM)based on wave theory is developed to analyze the transient response and natural characteristics of structural-acoustic coupling problems in an enclosed cavity.In the present method,the elastic dynamic equations and acoustic equation in heterogeneous medium are solved in solid domains and fluid domains respectively.The structural-acoustic coupling is implemented according to the continuity condition of the particle velocity along the normal direction and the normal traction equilibrium condition on the interface.Several numerical examples are presented to validate the effectiveness and accuracy of the present TDFVM.Then the effects of water depth on the acoustic and vibration characteristics and the natural characteristics of a structural-acoustic coupling system are analyzed.The numerical results show that the increase of water depth leads to a stronger coupling between the water and structure and the decrease of natural frequencies of coupling system,The computational cost and memory of this method are small and it can be applicable to structural-acoustic coupling problems in the heterogeneous fluid.  相似文献   

12.
We present a detailed comparison of dynamic space- and frequency-resolved and lumped erbium-doped fiber amplifier (EDFA) models. The space- and frequency-resolved models are based on an iterative solution of propagation equations for pump, multiple signals, and spectral components of forward and backward propagating amplified spontaneous powers and rate equations for pump, metastable, and ground energy level population densities of erbium ion. In contrast to space-resolved models, the lumped model solves a single ordinary differential equation for time evolution of the length-averaged metastable level population and is therefore substantially less computer time consuming. Both the space, and frequency-resolved and the lumped models give almost identical results when used for an analysis of surviving channel power excursions in concatenated EDFAs fed by multiwavelength signal and add/drop scenarios. For a statistical analysis of output power and signal-tonoise ratio fluctuations in EDFA cascades fed by burst-mode packet traffic, only lumped models can be used.  相似文献   

13.
镧和铕与邻菲罗啉谷氨酸配合物的NMR和IR研究   总被引:1,自引:0,他引:1  
合成了稀土镧和铕与谷氨酸,邻菲罗啉形成的二元及三元配合物,经元素分析确定该配合物的组成为Ln(phen)(Glu)3.7H2O(Ln=La,Eu);Eu(Glu)3;12H2O。用核磁共振和红外光谱研究与配体与稀土离子的配位方式,讨论了稀土离子的顺磁性及屏蔽效应对配合物的NMR谱图的影响。  相似文献   

14.
长期定位试验和ICP-AES测试相结合,研究了下辽河平原土壤有效Mn和Zn浓度变化以及不同施肥制度下大豆体内Mn和Zn浓度与含量的变化。结果表明:下辽河平原土壤有效Zn浓度已濒临临界值,应加强对其监测;大豆籽实和秸秆体内Zn浓度受施肥影响变化较小;而籽实中Mn浓度受施肥影响变化较大,且NPK和NPKO处理显著高于O和CK处理;养分循环再利用在增加大豆生物量的同时,Mn和Zn携出亦呈增加趋势;土壤-作物系统中,Mn和Zn均出现收支赤字,其赤字大小顺序为NPKO<O<CK<NPK,表明养分循环可以显著减缓这种赤字,使生态系统更可持续。  相似文献   

15.
The experimental rotational spectra of the deformed nuclei available in even-even and odd-A nuclei in the rare-earth and actinide regions are systematically analyzed with several rotational spectra formulas,including Bohr-Mottelson's I(I+l)-expansion,Harris'w2-expansion,ab and abc formulas.It is shown that the simple 2-parameter ab formula is much better than the widely used 2-parameter Bohr-Mottelson's AB formula and Harris'αβ formula.The available data of the rotational spectra of both ground-state band in even-even nuclei and one-quaasiparticle band in odd-A nuclei can be conveniently and rather accurately reproduced by ab formula and abc formula.The moment of inertia and the variation with rotational frequency of angular momentum can be satisfactorily reproduced by ab and abc formulas.  相似文献   

16.
We will present in this work the quantitative analysis of the relationship between the doping concentrations of GeO 2 and B 2 O 3 in the core and cladding regions and the temperature sensitivity of the resonance wavelength shift in long-period fiber gratings (LPFGs). Based on this analysis, the temperature sensitivity was suppressed and enhanced to 0.002 nm/°C and 0.28 nm/°C, respectively. We will also discuss the effect of the residual mechanical stress on the optical and mechanical properties of LPFGs. In particular, we will present the measurement results of the dependence of the refractive index change and mechanical strength on the residual mechanical stress in the boron-doped fibers with depressed clad and matched clad.  相似文献   

17.
This study reports the synthesis of palladium and rhodium metal nanoparticles supported on montmorillonite (MMT) and partially organically modified MMT (POMM) using tetraamine palladium and hexaamine rhodium complex as precursor for palladium and rhodium respectively. The synthesized nanoparticles were characterized by powder X-ray diffraction PXRD and TEM. The PXRD study shows characteristic crystallographic planes for Pd and Rh metal and confirm the formation of metal nanoparticles in MMT and POMM. The TEM images reveal the effect of organic modification of MMT on decreasing particle size of Pd and Rh metal. The Pd and Rh metal nanoparticles are agglomerated in pristine MMT while nanoparticles are well dispersed in POMM. ICP-AES analysis was carried out to estimate quantitative amount of Pd and Rh metal in MMT and POMM.  相似文献   

18.
There are three main astrophysical combustion systems: the evolution of stars, formation of interstellar dust and particulates, and the transition to hadrons in the early universe. These are described in terms of general combustion concepts, such as ignition, laminar and turbulent flames, detonations, multiphase flows, and particle and soot formation. Viewed in this way, the universe and many of its most important astronomical components are combustion systems, and we should use these as naturally occurring laboratories for exploring new and familiar combustion regimes. A more detailed discussion focuses on one type of combustion system, the ignition and development of turbulent flames in Type Ia supernovae, and the importance of the transition to a detonation.  相似文献   

19.
In the age of the Internet and with the dramatic proliferation of mobile listening technologies, music has unprecedented global distribution and embeddedness in people's lives. It is a source of intense experiences of both the most intimate and solitary, and public and collective, kinds – from an individual with their smartphone and headphones, to large-scale live events and global simulcasts; and it increasingly brings together a huge range of cultures and histories, through developments in world music, sampling, the re-issue of historical recordings, and the explosion of informal and home music-making that circulates via YouTube. For many people, involvement with music can be among the most powerful and potentially transforming experiences in their lives. At the same time, there has been increasing interest in music's communicative and affective capacities, and its potential to act as an agent of social bonding and affiliation. This review critically discusses a considerable body of research and scholarship, across disciplines ranging from the neuroscience and psychology of music to cultural musicology and the sociology and anthropology of music, that provides evidence for music's capacity to promote empathy and social/cultural understanding through powerful affective, cognitive and social factors; and explores ways in which to connect and make sense of this disparate evidence (and counter-evidence). It reports the outcome of an empirical study that tests one aspect of those claims, demonstrating that ‘passive’ listening to the music of an unfamiliar culture can significantly change the cultural attitudes of listeners with high dispositional empathy; presents a model that brings together the primary components of the music and empathy research into a single framework; and considers both some of the applications, and some of the shortcomings and problems, of understanding music from the perspective of empathy.  相似文献   

20.
BEPC Ⅱ,the upgrade project of Beijing Electron Positron Collider (BEPC),is an accelerator with large beam current and high luminosity,so an efficient and stable injector is required.Several beam diagnostic and monitoring instruments are used.A new diagnostic instrument--wire scanner,has been designed and will be used to nleasure the profile of the linac beam of BEPC Ⅱ.This paper describes the prototype of this system and the cause of heat generating of the wire.Some simulation results of the heat and force by using finite element method software-ANSYS(R),2) are presented and discussed.  相似文献   

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