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Computational Modelling and Simulations for Designing of Corrosion Inhibitors - Fundamentals and Realistic Applications (Paperback)
Loot Price: R4,705
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Computational Modelling and Simulations for Designing of Corrosion Inhibitors - Fundamentals and Realistic Applications (Paperback)
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Computational Modeling and Simulations for Designing of Corrosion
Inhibitors: Fundamentals and Realistic Applications offers a
collection of major advancements in the field of computational
modeling for the design and testing of corrosion inhibition
effectiveness of organic corrosion inhibitors. This guide presents
the latest developments in molecular modeling of organic compounds
using computational software, which has emerged as a powerful
approach for theoretical determination of corrosion inhibition
potentials of organic compounds. The book covers common techniques
involved in theoretical studies of corrosion inhibition potentials,
and mechanisms such as density functional theory, molecular
dynamics, Monte Carlo simulations, artificial neural networks, and
quantitative structure-activity relationship.
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