以下是文件包里的内容，初学者建议优先其中看打星号的：
*The Quantum Theory of Atoms in Molecules-From Solid State to DNA and Drug Design(Matta,Boyd)：这本书的第一章最适合初学者最初学习AIM的基本概念。后面的章节介绍了AIM理论在各个领域的拓展，给出了很多实例，可以有选择性地阅读。
*Some concepts in wavefunction analysis：是Multiwfn 2013年培训班中的幻灯片，后来又经过一些修订。AIM里的最重要的概念在里面都有涉及，从114页开始专门讲AIM拓扑分析和盆分析。
*Atoms in Molecules(from Encyclopedia of Computational Chemistry)、A quantum theory of molecular structure and its applications这两篇都是比较完整的AIM综述，推荐阅读。
Chemical Bonding and Molecular Geometry-From Lewis to Electron Densities：6、7两章和AIM直接相关，其它章节可以略过。
Atoms in Molecules-A Quantum Theory：这是Bader的代表作，是AIM的圣经。内容相对较深，不适合初学者，而适合专门希望深入研究的人阅读。
Atoms and Molecules.chm：这是来自Bader个人主页上的AIM介绍的页面组成的文档。
Are There Atoms in Molecules-ATOMS AND THE MOLECULAR STRUCTURE HYPOTHESIS：随便看看就行了。
Meaningful Structural Descriptors from Charge Density：这篇是个比较初级的AIM综述，没什么深入的内容，只对初学者有用。
Atoms in Molecules(Ruud Visser)、Bader Analysis-Calculating the Charge on Individual Atoms in Molecules & Crystals：这两个幻灯片都很一般，随便看看就行了。
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压缩包里“与AIM相关的有意义的文献和一些方法的原文”这个文件夹里是一些AIM领域方面的原文，以及一些笔者认为比较重要、有普遍意义的文献。文件名开头注明了文章主要内容。包含以下文件：
│ AIM定域化分析原文-Spatial localization of the electronic pair and number distributions in molecules.pdf
│ AIM最初文献-Virial Field Relationship for Molecular Charge Distributions and the Spatial Partitioning of Molecular Properties.pdf
│ AIM键级与椭率-Description of Conjugation and Hyperconjugation in Terms of Electron Distributions.pdf
│ AOM键级-Covalent bond orders in the topological theory of atoms in molecules.pdf
│ BCP判断成键类型-Experimental Electron Density Analysis of Mn2(CO)10-Metal-Metal and Metal-Ligand Bond Characterization.pdf
│ BCP处能量密度判断键类型-Chemical Bonds without Bonding Electron Density — Does the Difference Electron-Density Analysis Suffice for a Description of the Chemical Bond.pdf
│ eta指数判断成键类型-Experimental Charge Density Study of a Silylone.pdf
│ Li、Na晶体中有赝原子-Topological analysis of the charge density of solids-bcc sodium and lithium.pdf
│ NBCP-Natural Bond Critical Point Analysis-Quantitative Relationships Between Natural Bond Orbital-Based.pdf
│ Virial path-Structural homeomorphism between the electron density and the virial field.pdf
│ wfx格式原文-Subshell Fitting of Relativistic Atomic Core Electron Densities for Use in QTAIM Analyses of ECP-Based Wave Functions.pdf
│ 划分晶体类型-A Classification of Covalent, Ionic, and Metallic Solids Based on the Electron Density.pdf
│ 划分晶体类型-Bond metallicity of materials from real space charge density distributions.pdf
│ 多中心DI-Multicenter bonding within the AIM theory.pdf
│ 拉普拉斯键级-Bond Order Analysis Based on the Laplacian of Electron Density in Fuzzy Overlap Space.pdf
│ 源函数原文-A Green's function for the density.pdf
│ 源函数大综述-The Source Function Descriptor as a Tool to Extract Chemical Information from Theoretical and Experimental Electron Densities.pdf
│ 用0.001密度等值面定义范德华表面-Properties of atoms in molecules atomic volumes.pdf
│ 离域化指数-The Lewis Model and Beyond.pdf
│ 离域化指数、模糊键级、Mayer键级的对比-Comparison of the AIM Delocalization Index and the Mayer and Fuzzy Atom Bond Orders.pdf
│ 第一次实验且第一次在有机化合物中发现赝原子-First Experimental Characterization of a Non-nuclear Attractor in a Dimeric Magnesium(I) Compound.pdf
│ 赝势对AIM的影响-Topological analysis of electron density distribution taken from a pseudopotential calculation.pdf
│
├─IQA原子间能量成分分析
│ IQA分析卤键-On the Physical Nature of Halogen Bonds-A QTAIM Study.pdf
│ IQA原文-A Molecular Energy Decomposition Scheme for Atoms in Molecules.pdf
│ IQA原文-Interacting Quantum Atoms A Correlated Energy Decomposition Scheme Based on the Quantum Theory of Atoms in Molecules.pdf
│ IQA积分算法-Two-electron integrations in the quantum theory of atoms in molecules.pdf
│
└─弱相互作用相关
AIM、ELF联合分析氢键-Intramolecular Hydrogen Bonds-the QTAIM and ELF Characteristics.pdf
AIM研究二氢键-Comparative Study of Weak Interactions in Molecular Crystals-H-H Bonds vs Hydrogen Bonds.pdf
AIM研究二氢键-Properties of the C-H---H Dihydrogen Bond-An ab Initio and Topological Analysis.pdf
BCP动能密度，势能密度，曲率的关系-Experimental electron density overlapping in hydrogen bonds-topology vs. energetics.pdf
Charge Density Methods in Hydrogen Bond Studies.pdf
eta指数原文-Halogen Bonding-A Study based on the Electronic Charge Density.pdf
Lipkowski氢键AIM简化标准-Properties of the C-H---H Dihydrogen Bond An ab Initio and Topological Analysis.pdf
Popelier判断氢键存在的AIM标准-Characterization of C-H-0 Hydrogen Bonds on the Basis of the Charge Density.pdf
Rozas氢键强度分类-Behavior of Ylides Containing N, O, and C Atoms as Hydrogen Bond Acceptors.pdf
二氢键综述-Dihydrogen Bonds-Novel Feature of Hydrogen Bond Interactions(extracted from Practical Aspects of Computational Chemistry).pdf
拉普拉斯拓扑分析讨论卤键-Nature of halogen bonding.pdf
氢键键能、距离、G(r)、势能密度、键长的关系-Hydrogen bond strengths revealed by topological analyses of experimentally observed electron densities .pdf
能量密度除rho(Bond degree)-From weak to strong interactions.pdf
，楼主辛苦了
