EAN: 9783319156743

MOLECULAR DYNAMICS SIMULATIONS OF DISORDERED MA...

This book is a unique reference work in the area of atomic-scale simulation of glasses. For the
first time  a highly selected panel of about 20 researchers provides  in a single book  their
views  methodologies and applications on the use of molecular dynamics as a tool to describe
glassy materials. The book covers a wide range of systems covering traditional network glasses
such as chalcogenides and oxides  as well as glasses for applications in the area of phase
change materials. The novelty of this work is the interplay between molecular dynamics methods
(both at the classical and first-principles level) and the structure of materials for which 
quite often  direct experimental structural information is rather scarce or absent. The book
features specific examples of how quite subtle features of the structure of glasses can be
unraveled by relying on the predictive power of molecular dynamics  used in connection with a
realistic description of forces.

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