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CreatorTitleDescriptionSubjectDate
1 Liu, FengSimple generic method for predicting the effect of strain on surface diffusionWe show, by first-principles calculations, that the effect of external strain on surface diffusion is inherently correlated with the intrinsic surface stress induced by the adatom along its diffusion pathways. We demonstrate a simple generic method for a priori predicting quantitatively how an ext...Surface diffusion; First-principles calculations; Adatoms2001-11
2 Liu, FengDetermination of the Ehrlich-Schwoebel barrier in epitaxial growth of thin filmsWe demonstrate an approach for determining the "effective" Ehrlich-Schwoebel (ES) step-edge barrier, an important kinetic constant to control the interlayer mass transport in epitaxial growth of thin films. The approach exploits the rate difference between the growth and/or decay of an adatom and a...Ehrlich-Schwoebel barrier; Epitaxial growth; Step-edge barrier; Adatoms2006-11
3 Liu, FengStrain effect on adatom binding and diffusion in homo- and heteroepitaxies of Si and Ge on (001) SurfacesStrain dependence of adatom binding energies and diffusion barriers in homo- and heteroepitaxies of Si and Ge on s001d surface has been studied using first-principles calculations. In general, Si adatom binding energies and diffusion barriers are larger on Sis001d and Ges001d surfaces than a Ge ada...Strain effect; Adatom binding; Adatom diffusion; Adatoms; Heteroepitaxies; Homoepitaxies; (001) surfaces; Si; Ge2004-10
4 Liu, FengKinetics of mesa overlayer growth: climbing of adatoms onto the mesa topWe have calculated the energy barriers for an adatom climbing up onto a Pb mesa top either over a facet-facet edge or through a facet-step joint, using a modified embedded atom method. We found that the second process is not only thermodynamically more favorable than the first one but also much fast...Mesa overlayer growth; Adatoms; Epitaxial growth2008
5 Liu, FengQuantum size effect on adatom surface diffusionUsing scanning tunneling microscopy, we demonstrate that the nucleation density of Fe islands on the surface of nanoscale Pb films oscillates with the film thickness, providing a direct manifestation of the quantum size effect on surface diffusion. The Fe adatom diffusion barriers were derived to be...Quantum size effect; QSE; Adatoms; Surface diffusion; Fe islands; Nanoscale metallic structures; Epitaxial growth; Pb films2006-12
6 Liu, FengSeeing the atomic orbital: first-principles study of the effect of tip termination on atomic force microscopyWe perform extensive first-principles calculations to simulate the topographical atomic-force-microscope image of an adatom on the Si(111)-(7 X 7) surface, demonstrating the feasibility of imaging not only the atoms but also the atomic orbitals. Our comparative study of tip terminations shows that ...First-principles; Tip termination; Adatoms2003-06
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