A theoretical evaluation of the effects of carbon nanotube entanglement and bundling on the structural and mechanical properties of buckypaper

Structural formation mechanisms of carbon nanotube (CNT) buckypaper and their effects on its mechanical properties are studied with numerical simulations. A bond swap algorithm, resulting from coupling the molecular dynamics and Monte Carlo methods, has been developed to equilibrate initial structur...

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Veröffentlicht in:	Carbon (New York) 2012-04, Vol.50 (5), p.1793-1806
Hauptverfasser:	Li, Ying, Kröger, Martin
Format:	Artikel
Sprache:	eng
Schlagworte:	Bundling Carbon nanotubes Chemistry Colloidal state and disperse state Computer simulation Cross-disciplinary physics: materials science rheology Entanglement Exact sciences and technology Fullerenes and related materials diamonds, graphite General and physical chemistry Materials science Mathematical models Mechanical properties Physics Pore size Porosity Porous materials Specific materials
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