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Virtual porous carbons
Book chapter

Virtual porous carbons

Artur P. Terzyk, Sylwester Furmaniak, Piotr A. Gauden, Peter J. F. Harris and Piotr Kowalczyk
Novel Carbon Adsorbents, pp.61-104
Elsevier
2012

Abstract

Due to progress in the development of computers, molecular simulation techniques have become the basic tool of current theoretical chemistry. That is why using a computer, one can try to build a model of carbon and then perform molecular simulations to study different phenomena, among them adsorption processes [1–9]...

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