P. Havu

Materials Science · Physical Sciences

14h-index4.0kcitations21works0.02yr avg
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Research Topics

Graphene research and applications(9), Surface and Thin Film Phenomena(7), Quantum and electron transport phenomena(6), Carbon Nanotubes in Composites(5), Advancements in Semiconductor Devices and Circuit Design(5)

Publications21 total

Core level binding energies of functionalized and defective graphene
Beilstein Journal of Nanotechnology·2014· 88 citedOpen Access
Interaction of chlorine with Stone-Wales defects in graphene and carbon nanotubes and thermodynamical prospects of chlorine-induced nanotube unzipping
Physical Review B·2013· 18 citedOpen Access
Effects of chemical functionalization on electronic transport in carbon nanobuds
Physical Review B·2012· 10 citedOpen Access
Fracturing graphene by chlorination: A theoretical viewpoint
Physical Review B·2012· 23 citedOpen Access
Lennard‐Jones parameters for small diameter carbon nanotubes and water for molecular mechanics simulations from van der Waals density functional calculations
Journal of Computational Chemistry·2012· 38 cited
Hydrogenated graphene on silicon dioxide surfaces
Physical Review B·2011· 18 citedOpen Access
Spin-asymmetric graphene nanoribbons in graphane on silicon dioxide
Physical Review B·2011· 2 citedOpen Access
Effect of gating and pressure on the electronic transport properties of crossed nanotube junctions: formation of a Schottky barrier
Journal of Physics Condensed Matter·2011· 13 cited
Large-scale surface reconstruction energetics of Pt(100) and Au(100) by all-electron density functional theory
Physical Review B·2010· 64 citedOpen Access
Large-scale surface reconstructions from first principles: Au(100) and Pt(100) by all-electron DFT
Bulletin of the American Physical Society·2010
Efficient integration for all-electron electronic structure calculation using numeric basis functions
Journal of Computational Physics·2009· 582 cited
Ab initio molecular simulations with numeric atom-centered orbitals
Computer Physics Communications·2009· 2.8k citedOpen Access
Interfacial oxide growth at silicon∕high-k oxide interfaces: First principles modeling of the Si–HfO2 interface
Journal of Applied Physics·2006· 53 citedOpen Access
Erratum: Spin-dependent electron transport through a magnetic resonant tunneling diode [Phys. Rev. B<b>71</b>, 235301 (2005)]
Physical Review B·2006· 2 citedOpen Access
Finite-element implementation for electron transport in nanostructures
The Journal of Chemical Physics·2006· 21 citedOpen Access
Modeling of electronic transport in nanostructures
Aaltodoc (Aalto University)·2005Open Access
First principles electron transport: finite-element implementation for nanostructures
arXiv (Cornell University)·2005Open Access
Spin-dependent electron transport through a magnetic resonant tunneling diode
Physical Review B·2005· 55 citedOpen Access
Electron transport through quantum wires and point contacts
Physical Review B·2004· 49 citedOpen Access
Nonequilibrium electron transport in two-dimensional nanostructures modeled using Green’s functions and the finite-element method
Physical Review B·2004· 62 citedOpen Access
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Frequent Co-authors

Ville Havu(8), M. J. Puska(8), R. M. Nieminen(5), R. M. Nieminen(5), Volker Blüm(4), Matthias Scheffler(4), Mari Ijäs(4), Ari Harju(4), M. H. Hakala(3), Adam S. Foster(3), Esko I. Kauppinen(2), Patrick Rinke(2), Noora Tuomisto(2), R. Väänänen(2), Maria Kaukonen(2), E. Seppälä(2), Ralf Gehrke(1), Felix Hanke(1), Xinguo Ren(1), Karsten Reuter(1)