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Optics and Spectroscopy for Fluid Characterization.
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Optics and Spectroscopy for Fluid Characterization.
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Optics and Spectroscopy for Fluid Characterization.
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This dissertation by Yuan Liu focuses on the theoretical study of natural gas hydrates and hydrogen-bonded clusters and crystals using density functional theory (DFT) computations. It explores the thermodynamic stability, Raman spectra, and NMR chemical shifts of hydrocarbon molecules in various clathrate crystalline phases. The research highlights the significance of natural gas hydrates as a potential energy resource, their environmental impact, and their role in technological applications. The study also examines the properties of water clusters and ice crystals, particularly ice XI, which could have implications for planetary formation. The work extends the understanding of clathrate ice phases under negative pressure and proposes new structures based on first-principles computations. This research is aimed at scientists and researchers in the fields of chemistry, physics, and environmental science.
Hydrogen bonding. --- Crystals. --- Hydrogen bonding --- Crystals
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Volume 72 addresses the role of peptide backbone solvation in the energetics of protein folding. Particular attention is focused on modeling and computation. This volume will be of particular interest to biophysicists and structural biologists.*Challenges the longstanding and basic assumptions of structural biology*Discusses how to solve the problem of protein structure prediction*Addresses the quantitation of the energetics of folding
Peptides. --- Solvation. --- Hydrogen bonding.
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There has been an increased interest among researchers in hydrogen-bonded interpolymer complexes since the first pioneering papers were published in the early 1960's. Several hundred research papers have been published on various aspects of complex formation reactions in solutions and interfaces, properties of interpolymer complexes and their potential applications. This book focuses on the latest developments in the area of interpolymer complexation via hydrogen bonding. It represents a collection of original and review articles written by recognized experts from Germany, Greece, Kazakhstan...
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