Low-Energy Electron Scattering from Molecules, Biomolecules and Surfaces
Low-Energy Electron Scattering from Molecules, Biomolecules and Surfaces
复制标题
分子、生物分子和表面的低能电子散射
DOI：
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发表时间：
2011
期刊：
影响因子：
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通讯作者：
Petr Curik
中科院分区：
文献类型：
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作者：
Roman Carsky;Petr Curik
电子散射在物理、化学和生物学研究中的应用：低能电子-分子碰撞物理学概述与导论书的组织数值方法导论单中心展开静态交换近似相关极化势r矩阵法施温格变分原理Kohn变分原理复旋转多重散射方法孤立分子电子散射绝对截面的测量实验方法氮一氧化碳卤化氢、卤化甲基、CH3I无永久偶极子的振动feshach共振作为DEA的门道态，π *形状共振作为DEA含OH和SH分子的门道态，其他多原子分子简写共振电子-分子散射非定域理论介绍非定域共振理论双原子分子角动量的详细处理核动力学方程的数值处理非定域共振理论在双原子分子中的应用介绍双原子分子的非定域共振模型概述横截面结构及其解释横截面和速率常数的温度依赖性电子与DNA及其亚基相互作用的理论研究：从四氢呋喃到质粒DNA介绍分子单位大型DNA分子结构简写表面低能电子散射引入电子散射通过能量损失谱的振动模式分析准弹性电子反射率真空能级以上态密度的全局探测振动激发函数（VEF）振动模式表征结论多原子分子的振动激发引入基本理论离散动量表示方法数值正交库仑积分的计算交换积分的评价偏振效应计算细节多原子分子的应用
Electron scattering as a useful tool for research in physics, chemistry and biology: overview and introductory remarks Physics of low-energy electron-molecule collisions Organization of the book Introduction to numerical methods Single-center expansion Static-exchange approximation Correlation-polarization potentials R-matrix approach Schwinger variational principle Kohn variational principle Complex rotation Multiple scattering methods Measurement of absolute cross sections of electron scattering by isolated molecules Introduction Experimental methods Nitrogen Carbon monoxide Hydrogen halides Methyl halides CH3I Vibrational Feshbach resonances without a permanent dipole Vibrational Feshbach resonances as doorway states to DEA pi* shape resonances as a doorway states to DEA OH and SH containing molecules Other polyatomic molecules Summary and Conclusions Appendix: Abbreviations Nonlocal theory of resonance electron-molecule scattering Introduction Nonlocal resonance theory Detailed treatment of angular momentum for diatomic molecules Numerical treatment of the nuclear dynamics equations Applications of the nonlocal resonance theory to diatomic molecules Introduction Overview of the nonlocal resonance models for diatomic molecules Structures in the cross sections and their interpretation Temperature dependence of the cross sections and rate constants Appendix: details of nonlocal resonance models for diatomic molecules Theoretical studies of electron interactions with DNA and its subunits: from tetrahydrofuran to plasmid DNA Introduction Molecular units Large DNA molecular structures Appendix: Abbreviations Low-energy electron scattering at surfaces Introduction Electron scattering Vibrational pattern analysis through energy loss spectra Quasi-elastic electron reflectivity - Global probe of the density-of-states above vacuum level Vibrational excitation functions (VEF) - Vibrational modes characterization Conclusion Vibrational excitations of polyatomic molecules Introduction Basic theory Discrete momentum representation method Numerical quadrature Evaluation of Coulomb integrals Evaluation of exchange integrals Polarization effects Computational details Application to polyatomic molecules