R. Czajka et al., Surface physics at the nano-scale via scanning probe microscopy and molecular dynamics simulations, PROG SURF S, 59(1-4), 1998, pp. 13-23
Probe-based scanning microscopes, such as the STM and the AFM, are used to
obtain the topographical and electronic structure maps of material surfaces
, and to modify their morphologies on nanoscopic scales. They have generate
d new areas of research in condensed matter physics and materials science.
We will review some examples from the fields of experimental nano-mechanics
, nano-electronics and nano-magnetism. These now form the basis of the emer
ging field of Nano-technology, A parallel development has been brought abou
t in the held of Computational Nana-science, using quantum-mechanical techn
iques and computer-based numerical modelling, such as the Molecular Dynamic
s (MD) simulation method. We will report on the simulation of nucleation an
d growth of nano-phase films on supporting substrates. Furthermore, a theor
etical modelling of the formation of STM images of metallic clusters on met
allic substrates will also be discussed within the non-equilibrium Keldysh
Green function method to study the effects of coherent tunnelling through d
ifferent atomic orbitals in a tip-sample geometry.