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Proceedings of the 8th International Conference on Attosecond Science and Technology [E-Book] /
Table of Contents: ... chiral sensitivity in photoionization with bichromatic fields -- Chapter 13. Experimental investigation of topological property of degenereate singularities in rescattering processes -- Chapter 14. Simulating strong field tunnel ionization of molecules...

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Topological Approaches to the Chemical Bond [E-Book] /
Table of Contents: ...Introduction -- Topological spaces -- Part I Descriptors -- The electron density -- Electron pairing descriptors -- Weak interactions -- Part II Applications -- Molecules -- Solid state -- Part III Exercises -- Algorithms & software -- Exercises...

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Mathematical Physical Chemistry [E-Book] : Practical and Intuitive Methodology /
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Handbook of Macrocyclic Supramolecular Assembly [E-Book] /
Chen, Yong
2020
Table of Contents: ... Bilayers -- Chapter 7. Construction and Biomedical Applications of Macrocycle-based Supramolecular Topological Polymers -- Chapter 8. Supermolecules as Medicinal Drugs -- Chapter 9. Nanoscaled Cyclodextrin Supermolecular System for Drug and Gene Delivery...

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A Network-Based Approach to Cell Metabolism [E-Book] : From Structure to Flux Balances /
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Recent Advances in Complex Functional Materials [E-Book] : From Design to Application /
Table of Contents: ... and Real-Space Topology: Understanding Electron Flow, Molecular Mechanism and Material Behaviour....

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The Chemical Bond II [E-Book] : 100 Years Old and Getting Stronger /
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Hydrogen Bonding—New Insights [E-Book] /
Table of Contents: ... -- Molecular Geometry—Distant Consequences of H-Bonding -- Topology of X-Ray Charge Density of Hydrogen Bonds -- Structure–Property Relations for Hydrogen-Bonded Solids -- Unrevealing the Nature of Hydrogen Bonds: ?-Electron Delocalization Shapes H-Bond Features...

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Frontiers of Multifunctional Integrated Nanosystems [E-Book] : Proceedings of the NATO ARW on Frontiers of Molecular-scale Science and Technology of Nanocarbon, Nanosilicon and Biopolymer Integrated Nanosystems,Ilmenau, Germany from 12 to 16 July 2003 /
Table of Contents: ...Modeling and computer simulation of characteristics nanosystems -- Optical Properties of Small-Radius SWNTs within a Tight-Binding Model -- The Electronic Structure of Nanotubes and the Topological Arrangements of Carbon Atoms -- Irradiation Effect...

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Intermolecular Forces and Clusters I [E-Book] /
Table of Contents: ...P.L.A. Popelier: Quantum Chemical Topology: on Bonds and Potentials -- A. Soncini, P.W. Fowler, L.W. Jenneskens: Angular Momentum and Spectral Decomposition of Ring Currents: Aromaticity and the Annulene Model -- S.L. Price, L.S. Price: Modelling...

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11
Polymer Analysis Polymer Theory [E-Book].
2005
Table of Contents: ... Surfaces Imaged by Atomic Force Microscopy and Complementary Approaches -- S. Ito, H. Aoki: Nano-Imaging of Polymers by Optical Microscopy -- A.A. Gurtovenko, A. Blumen: Generalized Gaussian Structures: Models for Polymer Systems with Complex Topologies....

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Polyoxometalate Molecular Science [E-Book] /
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Metal-Ligand Interactions [E-Book] : Molecular, Nano-, Micro-, and Macro-systems in Complex Environments /
Table of Contents: ... Correlation: Quantum Chemistry’s Holy Grail -- What Can Tell Topological Approaches on the Bonding in Transition Metal Compounds -- Metal-DNA interactions -- Possible Electronic Modifications of VO-based Catalysts -- Electronic Properties, Spectroscopic Properties...

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Radiation Effects on Polymers for Biological Use [E-Book] /
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From Chemical Topology to Three-Dimensional Geometry [E-Book] /
Table of Contents: ... from Amino Acid Sequence -- On Characterization of 3D Molecular Structure -- Chemical Graph Theory of Fullerenes -- Recent Work on Toroidal and Other Exotic Fullerene Structures -- All-Conjugated Carbon Species -- Applications of Topology and Graph Theory...

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Fundamentals of Molecular Similarity [E-Book] /
Table of Contents: ...1. Prediction of Boiling Points of Organic Compounds from Molecular Descriptors by Using Backpropagation Neural Network -- 2. Some Relationships between Molecular Energy-Topology and Symmetry -- 3. Database Organization and Similarity Searching with E...

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New Trends in Quantum Systems in Chemistry and Physics [E-Book] : Volume 1 Basic Problems and Model Systems Paris, France, 1999.
2001
Table of Contents: ...) Based on the Topological Analysis of the Electron Localisation Function (ELF) -- Symmetry-separated (?+?) vs Bent-bond (?) Models of First-row Transition-metal Methylene Cations -- Hartree-fock Study of Hydrogen-bonded Systems in the Absence of Basis-set...

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18
Perspectives on Solid State NMR in Biology [E-Book] /
Table of Contents: ...-state NMR spectroscopy of polypeptides reconstituted into oriented phospholipid membranes -- From Topology to High Resolution Membrane Protein Structures -- Toward dipolar recoupling in macroscopically ordered samples of membrane proteins rotating...

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Polyoxometalate Chemistry From Topology via Self-Assembly to Applications [E-Book] /
Table of Contents: ...to Polyoxometalate Chemistry : From Topology via Self-assembly to Applications -- Synthetic Strategies -- Rational Approaches to Polyoxometalate Synthesis -- Functionalization of Polyoxometalates : Achievements and Perspectives -- From the First...

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20
Many-Electron Densities and Reduced Density Matrices [E-Book] /
Table of Contents: ... Matrix and Density Functional Theory: An Illustration for Hooke’s Atom -- IV. Electron Intracule and Extracule Densities -- 11. Intracule and Extracule Densities: Historical Perspectives and Future Prospects -- 12. Topology of Electron Correlation -- 13...

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