能带结构计算 band structure calculation(4)   band structure calculation      We calculated the energy band structures of the double TI-O layer TI-Ba-Ca-CuO oxide superconductors by performing the tight-binding band structure calculation method on the basis of EHT approximation.      利用EHT近似下的紧束缚能带结构计算方法计算了Tl-Ba-Ca-Cu氧化物超导体双Tl-O层体系的能带结构。 短句来源      We calculated the energy band structures of YBa_2Cu_3O_(7-δ)andYBa_2Cu_3O_6 by performing the tight-binding band structure calculation methodon the basis of EHT approximation.      采用EHT近似下的紧束缚能带结构计算方法，计算了YBa＿2Cu＿3O＿（7－δ）和YBa＿2Cu＿3O＿6的能带结构。 短句来源      Based on a recent band structure calculation,the electron transport properties in Nitrogen-doped 4H-SiC were investigated by an ensemble Monte Carlo technique with a single nonparabolic band model.      在最新能带结构计算的基础之上,采用非抛物性能带模型对掺氮4H-SiC电子输运特性进行了多粒子蒙特卡罗(EnsembleMonteCarlo)研究. 短句来源      By the electronic band structure calculation based on first-principles, we, for the first time, forecast a significant enhancement of electronic conductivity when lithium ions are replaced by cations with higher valence, Cr3+, and two kinds of possible conduction mechanisms are proposed. Thus, a variety of possible controversy and doubt is clarified.      通过第一性原理电子能带结构计算,首次从理论上预测了对LiFePO4的Li位进行Cr掺杂可以大幅度提高LiFePO4的电子电导率,并就此提出了两种可能的导电机理,从而澄清了各种可能的争论和质疑. 短句来源   “能带结构计算”译为未确定词的双语例句      The electronic structure calculation shows, the magnetic moments of Fe (4c), Fe (8ji) and Fe (16k2) are lowered, while the magnetic moments of Fe (4e) are increased.      能带结构计算表明氮原子的介入使Fe(4c)、Fe(8j1)和Fe(16k2)的磁矩降低，Fe(4e)磁矩增大。 短句来源      Calculation of Energy Band of Bi-Te Based Thermoelectric Material      Bi-Te基热电材料的能带结构计算 短句来源      Calculation of Band Structure of Doped Polyacetylene      掺杂聚乙炔的能带结构计算 短句来源      The energy band structures of Bi-Sr-Ca-Ou-o superconductors were calculated by performing the tight-binding calculation method on the basis of EHT approximation.      利用EHT近似下的紧束缚能带结构计算方法计算了Bi-Sr-Ca-Cu-O超导体的能带结构. 短句来源      The bands of metallic coordinated polymers[｛HgX 2(bipy)｝ n]with layer skeleton (X=Cl,Br;bipy=4,4′ bipyridyl)have been calculated by the EHT crystal orbital method. The main bonding of energy bands has been discussed by the Band Vector Method.      用紧束缚 (EHT)晶体轨道方法对层状金属配位聚合物 [{HgX2 (bipy) }n](X =Cl,Br ;bipy =4 ,4′ bipyridyl)进行了能带结构计算 ,并利用键向量方法对这一系列聚合物能带特征和成键性质进行了讨论。 短句来源 更多          相似匹配句对      Calculation of Band Structure of Doped Polyacetylene      掺杂聚乙炔的能带结构计算 短句来源      CALCULATION OF ENERGIES AND BAND STRUCTURES OF POLYDIACETYLENES      聚丁二炔的能量和能带结构计算 短句来源      Bandstructure of Metal Ytterbium Calculated by LCAO Method      金属镱能带结构的LCAO计算 短句来源      LMTO-ASA Band Structure Calculation of MgO      MgO能带结构的LMTO-ASA计算 短句来源      Calculation of Energy Band of Diamond      金刚石能带的计算 短句来源 查询“能带结构计算”译词为用户自定义的双语例句     我想查看译文中含有：的双语例句 为了更好的帮助您理解掌握查询词或其译词在地道英语中的实际用法，我们为您准备了出自英文原文的大量英语例句，供您参考。   band structure calculation The formalism for the band structure calculation is presented by taking into account the full vector character of the elastic wave. 例句来源       The Schr?dinger equation is solved for atomic potentials which have been obtained in a self-consistent band structure calculation. 例句来源       The experimental anisotropies are in very satisfactory agreement with earlier measurements and there is good qualitative agreement between the experimental data and a recent band structure calculation. 例句来源       Because of the variational character of the most of the modern band structure calculation methods, including LMTO, the calculated electron energies are much more accurate than the wave functions. 例句来源       A self-consistent LAPW band structure calculation of Cu2O is presented. 例句来源       更多                    In this paper, a Scalar Eelativiatic Green's Function method ( SRA-KKR) neglecting spin-orbit coupling effect has been proposed for the energy band calculation. With this method, only a few modifications to the Non-Relativistic Green's Function method would be needed in order to obtain the relativiatic effect on the electronic band structure of solid.             略去自旋轨道耦合效应,在标量相对论近似下本文提出了一个近似的、相对论格林函数电子能带结构计算法。用这个方法可以对非相对论格林函数计算电子能带结构方法稍加改变就得到相对论效应对电子结构的影响。 文摘来源          Helix-symmetrical polymer possesses not only translation symmetry,but also             螺旋高分子不仅具有平移对称性,而且有转动对称性.我们用一种新的线性组合方法 LCAO/TO-LCTO/HO-LCHO/PO(T——translation-periodic,H——periodic)推导了螺旋对称高分子的久期方程,使它的建立和求解都大为简化,并使其阶数从 n×P(n 为螺旋轴的重数,也表示平移单元中包含的螺旋单元数;P 为每个螺旋单元中的原子轨道数)降为 P 阶.本文还制定了直接解复广义本征值问题的 EHMO 计算方案.以聚乙烯和聚乙炔为例做了电子能带结构的计算. 文摘来源          Based on the distingush ed feature of the all-electron LMTO-ASA method, a LMTO ASA Virtual Crystal Approximation (VCA) method for calculating band structure of semiconductor alloy is suggested and applied to the Ga1. xA1xAs system. It is found that the compositional dependence of band structure, density of states and bowing parameter clearly shows the basic feature of the VCA. The sum of valence electronic energies in alloy and the valency charge contained in the ASA spheres are found to be linearly depende...             本文依据全电子LMTO-ASA能带计算方法的特点,提出LMTO-ASA-VCA合金能带结构计算的虚晶近似方案,用于Ga_(1-x)AlxAs的计算,所得各组分下的能带结构、态密度及弯曲参数等均显示虚晶近似的特征,合金的价电子能量总和及ASA球中包含的价电子电荷数随组分的变化都接近于线性,表明本计算方案是合理可行的. 文摘来源   << 更多相关文摘         相关查询: 能带结构 表面能带结构 光子能带结构 自身能带结构 电子能带结构 投影能带结构 能带边结构 界面能带结构 能带结构计算法 光子晶体的能带结构 二维能带结构 结构  对查询结果不满意

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