Computational Modelling and Simulations for Designing of Corrosion Inhibitors : Fundamentals and Realistic Applications
Book Details
Format
Paperback / Softback
ISBN-10
0323951619
ISBN-13
9780323951616
Publisher
Elsevier - Health Sciences Division
Imprint
Elsevier - Health Sciences Division
Country of Manufacture
NL
Country of Publication
GB
Publication Date
Apr 24th, 2023
Print length
564 Pages
Weight
1,112 grams
Dimensions
19.10 x 23.60 x 3.80 cms
Product Classification:
Chemical engineeringMetals technology / metallurgy
Ksh 31,500.00
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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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