Electronic Material Properties - und Geowissenschaften ...
Electronic Material Properties - und Geowissenschaften ...
Electronic Material Properties - und Geowissenschaften ...
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Guest Scientist<br />
Research Projects<br />
Prof. Kai Nordl<strong>und</strong>, PhD; University of Helsinki, Finland<br />
Niklas Juslin, MSc; University of Helsinki, Finland<br />
Tommi Järvi, MSc; University of Helsinki, Finland<br />
Petra Träskelin, MSc; University of Helsinki, Finland<br />
Eero Kesälä; University of Helsinki, Finland<br />
Atomistic computer simulations of defects and their mobility in metal-oxides (DFG-SFB<br />
595, Project C2, 2003-2006 )<br />
Atomistic modelling of metal oxide and -carbide nanoscale systems (DAAD, PPP Finland,<br />
2003-2006)<br />
Polymeric nitrogen (DFG, Al 578-3, 2005-2007)<br />
Plasticity of nanocrystalline metals and alloys, (DFG FOR 714, 2006 – 2009)<br />
Metallic nanoglasses (DFG Al 578-6, 2006 – 2007)<br />
Publications<br />
Zhao, S.J.; Albe, K.; Hahn, H.; Grain size dependence of the bulk modulus of<br />
nanocrystalline nickel, Scripta Mat. 55 (2006) 473-476)<br />
Erhart, P.; Juslin, N.; Goy, K.; Nordl<strong>und</strong>, R.; Müller, M.; Albe, K.; Analytic bond-order<br />
potential for atomistic simulations of zinc oxide, J. Phys. Cond. Matter 18 (2006) 8565-<br />
6605<br />
Erhart, P.; Albe, K.; Diffusion of zinc vacancies and interstitials in zinc oxide, Appl. Phys.<br />
Lett. 88 (2006) 201918<br />
Erhart, P.; Albe, K.; Klein, A.: First-principles study of intrinsic point defects in Zn0: Role of<br />
band structure, volume relaxation and finite size effects, Phys. Rev. B 73 (2006) 205203<br />
Erhart, P.; Albe, K.; First-principles study of migration mechanisms and diffusion of oxygen<br />
in zinc oxide, Phys.Rev.B 73 (2006) 115207<br />
Jin, Z.-H.; Gumbsch, P.; Ma, E.; Albe, K.; Lu, K.; Hahn, H.; Gleiter, The interaction<br />
mechanism of screw dislocations with coherent twin bo<strong>und</strong>aries in different face-centred<br />
cubic metals, Scripta Mat., 54 (6) (2006) 1163-1168<br />
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