O(N) algorithms in tight-binding molecular-dynamics simulations of the electronic structure of carbon nanotubes

Physical Review B 67, 035415 (2003) The O(N) and parallelization techniques have been successfully applied in tight-binding molecular-dynamics simulations of single-walled carbon nanotubes (SWNTs) of various chiralities. The accuracy of the O(N) description is found to be enhanced by the use of basi...

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Hauptverfasser:	Dereli, G, Ozdogan, C
Format:	Artikel
Sprache:	eng
Schlagworte:	Physics - Disordered Systems and Neural Networks Physics - Materials Science Physics - Mesoscale and Nanoscale Physics Physics - Other Condensed Matter Physics - Quantum Gases Physics - Soft Condensed Matter Physics - Statistical Mechanics Physics - Strongly Correlated Electrons Physics - Superconductivity
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