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Nanotechnology

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2013

Civil and Environmental Engineering

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Crystalline Cellulose – Atomistic Modeling Toolkit, Mateo Gomez, Pablo Zavattieri Dr. Oct 2013

Crystalline Cellulose – Atomistic Modeling Toolkit, Mateo Gomez, Pablo Zavattieri Dr.

The Summer Undergraduate Research Fellowship (SURF) Symposium

Nature has created efficient strategies to make materials with hierarchical internal structure that often exhibit exceptional mechanical properties. One such example is found in cellulose, in fact it is eight times stronger than stainless steel and advantage is that cellulose incredibly cheap, because processing is obtained from purified wood pulp (it is environmental friendly). The most prevalent modeling technique to study the fundamental mechanical behavior of the crystalline cellulose has been Molecular Dynamics (MD). As a predictive tool, MD allows us to study the behavior of crystalline cellulose at the atomic level, and as such, it accurately predicts the crystalline ...