Publications
Closing the gap between nano- and macroscale: Atomic interactions vs. macroscopic materials behavior
T. Böhme, T. Hammerschmidt, R. Drautz, T. Pretorius.
J. C. Moreno-Piraján,Thermodynamics - Kinetics of Dynamic Systems, InTech, Rijeka, Croatia, 129-164, (2011)
Keyword(s): density functional theory; bond order potentials
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