Beomseok Nam, Henrique Andrade, et al.
ACM/IEEE SC 2006
A challenging paradigm in the computational sciences is the coupling of the continuum, the atomistic and the quantum descriptions of matter for a unified dynamic treatment of a single physical problem. We described the achievement of such a goal. We have spanned the length scales in a concerted simulation comprising the finite-element method, classical molecular dynamics, quantum tight-binding dynamics and seamless bridges between these different physical descriptions. We illustrate and validate the methodology for crack propagation in silicon.
Beomseok Nam, Henrique Andrade, et al.
ACM/IEEE SC 2006
John M. Boyer, Charles F. Wiecha
DocEng 2009
David A. Selby
IBM J. Res. Dev
Yigal Hoffner, Simon Field, et al.
EDOC 2004