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  Author Title Year (down) Publication Volume Times cited Additional Links Links
Amini, M.N.; Saniz, R.; Lamoen, D.; Partoens, B. The role of the VZn-NO-H complex in the p-type conductivity in ZnO 2015 Physical chemistry, chemical physics 17 20 UA library record; WoS full record; WoS citing articles pdf url doi
Euan-Diaz, E.; Herrera-Velarde, S.; Misko, V.R.; Peeters, F.M.; Castaneda-Priego, R. Structural transitions and long-time self-diffusion of interacting colloids confined by a parabolic potential 2015 The journal of chemical physics 142 7 UA library record; WoS full record; WoS citing articles doi
Bal, K.M.; Neyts, E.C. On the time scale associated with Monte Carlo simulations 2014 The journal of chemical physics 141 26 UA library record; WoS full record; WoS citing articles url doi
Bekaert, J.; Saniz, R.; Partoens, B.; Lamoen, D. Native point defects in CuIn1-xGaxSe2 : hybrid density functional calculations predict the origin of p- and n-type conductivity 2014 Physical chemistry, chemical physics 16 43 UA library record; WoS full record; WoS citing articles pdf url doi
Sarmadian, N.; Saniz, R.; Partoens, B.; Lamoen, D.; Volety, K.; Huyberechts, G.; Paul, J. High throughput first-principles calculations of bixbyite oxides for TCO applications 2014 Physical chemistry, chemical physics 16 23 UA library record; WoS full record; WoS citing articles pdf doi
Çakir, D.; Sahin, H.; Peeters, F.M. Doping of rhenium disulfide monolayers : a systematic first principles study 2014 Physical chemistry, chemical physics 16 58 UA library record; WoS full record; WoS citing articles pdf doi
Brito, B.G.A.; Hai, G.-Q.; Teixeira Rabelo, J.N.; Cândido, L. A quantum Monte Carlo study on electron correlation in all-metal aromatic clusters MAl4 – (M = Li, Na, K, Rb, Cu, Ag and Au) 2014 Physical chemistry, chemical physics 16 10 UA library record; WoS full record; WoS citing articles pdf doi
Singh, S.K.; Neek-Amal, M.; Peeters, F.M. Electronic properties of graphene nano-flakes : energy gap, permanent dipole, termination effect, and Raman spectroscopy 2014 The journal of chemical physics 140 30 UA library record; WoS full record; WoS citing articles pdf doi
Mees, M.J.; Pourtois, G.; Rosciano, F.; Put, B.; Vereecken, P.M.; Stesmans, A. First-principles material modeling of solid-state electrolytes with the spinel structure 2014 Physical chemistry, chemical physics 8 UA library record; WoS full record; WoS citing articles doi
Amini, M.N.; Dixit, H.; Saniz, R.; Lamoen, D.; Partoens, B. The origin of p-type conductivity in ZnM2O4 (M = Co, Rh, Ir) spinels 2014 Physical chemistry, chemical physics 16 47 UA library record; WoS full record; WoS citing articles pdf doi
Shariat, M.; Shokri, B.; Neyts, E.C. On the low-temperature growth mechanism of single walled carbon nanotubes in plasma enhanced chemical vapor deposition 2013 Chemical physics letters 590 14 UA library record; WoS full record; WoS citing articles doi
Bittencourt, C.; Ke, X.; Van Tendeloo, G.; Tagmatarchis, N.; Guttmann, P. NEXAFS spectromicroscopy of suspended carbon nanohorns 2013 Chemical physics letters 587 4 UA library record; WoS full record; WoS citing articles pdf doi
Verberck, B.; Okazaki, T.; Tarakina, N.V. Ordered and disordered packing of coronene molecules in carbon nanotubes 2013 Physical chemistry, chemical physics 15 9 UA library record; WoS full record; WoS citing articles doi
Schoeters, B.; Neyts, E.C.; Khalilov, U.; Pourtois, G.; Partoens, B. Stability of Si epoxide defects in Si nanowires : a mixed reactive force field/DFT study 2013 Physical chemistry, chemical physics 15 3 UA library record; WoS full record; WoS citing articles url doi
Adjizian, J.J.; De Marco, P.; Suarez-Martinez, I.; El Mel, A.A.; Snyders, R.; Gengler, R.Y.N.; Rudolf, P.; Ke, X.; Van Tendeloo, G.; Bittencourt, C.; Ewels, C.P.; Platinum and palladium on carbon nanotubes : experimental and theoretical studies 2013 Chemical physics letters 571 23 UA library record; WoS full record; WoS citing articles pdf doi
Houssa, M.; van den Broek, B.; Scalise, E.; Pourtois, G.; Afanas'ev, V.V.; Stesmans, A. An electric field tunable energy band gap at silicene/(0001) ZnS interfaces 2013 Physical chemistry, chemical physics 15 74 UA library record; WoS full record; WoS citing articles pdf doi
Massobrio, C.; Djimbi, D.M.; Matsubara, M.; Scipioni, R.; Boero, M. Stability of Ge12C48 and Ge20C40 heterofullerenes : a first principles molecular dynamics study 2013 Chemical physics letters 556 3 UA library record; WoS full record; WoS citing articles doi
Navío, C.; Vallejos, S.; Stoycheva, T.; Llobet, E.; Correig, X.; Snyders, R.; Blackman, C.; Umek, P.; Ke, X.; Van Tendeloo, G.; Bittencourt, C.; Gold clusters on WO3 nanoneedles grown via AACVD : XPS and TEM studies 2012 Materials chemistry and physics 134 52 UA library record; WoS full record; WoS citing articles pdf doi
Sliem, M.A.; Turner, S.; Heeskens, D.; Kalidindi, S.B.; Van Tendeloo, G.; Muhler, M.; Fischer, R.A. Preparation, microstructure characterization and catalytic performance of Cu/ZnO and ZnO/Cu composite nanoparticles for liquid phase methanol synthesis 2012 Physical chemistry, chemical physics 14 16 UA library record; WoS full record; WoS citing articles pdf doi
Bittencourt, C.; Ke, X.; Van Tendeloo, G.; Thiess, S.; Drube, W.; Ghijsen, J.; Ewels, C.P. Study of the interaction between copper and carbon nanotubes 2012 Chemical physics letters 535 27 UA library record; WoS full record; WoS citing articles pdf doi
Ao, Z.M.; Hernández-Nieves, A.D.; Peeters, F.M.; Li, S. The electric field as a novel switch for uptake/release of hydrogen for storage in nitrogen doped graphene 2012 Physical chemistry, chemical physics 14 67 UA library record; WoS full record; WoS citing articles pdf doi
Scipioni, R.; Matsubara, M.; Ruiz, E.; Massobrio, C.; Boero, M. Thermal behavior of Si-doped fullerenes vs their structural stability at T = 0 K : a density functional study 2011 Chemical physics letters 510 14 UA library record; WoS full record; WoS citing articles doi
Zeng, Y.I.; Menghini, M.; Li, D.Y.; Lin, S.S.; Ye, Z.Z.; Hadermann, J.; Moorkens, T.; Seo, J.W.; Locquet, J.-P.; van Haesendonck, C. Unexpected optical response of single ZnO nanowires probed using controllable electrical contacts 2011 Physical chemistry, chemical physics 13 7 UA library record; WoS full record; WoS citing articles doi
Aerts, A.; Follens, L.R.A.; Biermans, E.; Bals, S.; Van Tendeloo, G.; Loppinet, B.; Kirschhock, C.E.A.; Martens, J.A. Modelling of synchrotron SAXS patterns of silicalite-1 zeolite during crystallization 2011 Physical chemistry, chemical physics 13 22 UA library record; WoS full record; WoS citing articles pdf doi
Lorenz, H.; Zhao, Q.; Turner, S.; Lebedev, O.I.; Van Tendeloo, G.; Klötzer, B.; Rameshan, C.; Penner, S. Preparation and structural characterization of SnO2 and GeO2 methanol steam reforming thin film model catalysts by (HR)TEM 2010 Materials chemistry and physics 122 15 UA library record; WoS full record; WoS citing articles pdf doi
Neyts, E.; Shibuta, Y.; Bogaerts, A. Bond switching regimes in nickel and nickel-carbon nanoclusters 2010 Chemical physics letters 488 20 UA library record; WoS full record; WoS citing articles doi
Georgieva, V.; Todorov, I.T.; Bogaerts, A. Molecular dynamics simulation of oxide thin film growth: importance of the inter-atomic interaction potential 2010 Chemical physics letters 485 16 UA library record; WoS full record; WoS citing articles doi
Verberck, B.; Vliegenthart, G.A.; Gompper, G. Orientational ordering in solid C60 fullerene-cubane 2009 The journal of chemical physics 130 8 UA library record; WoS full record; WoS citing articles doi
Bittencourt, C.; Hecq, M.; Felten, A.; Pireaux, J.J.; Ghijsen, J.; Felicissimo, M.P.; Rudolf, P.; Drube, W.; Ke, X.; Van Tendeloo, G. Platinumcarbon nanotube interaction 2008 Chemical physics letters 462 62 UA library record; WoS full record; WoS citing articles pdf doi
Hermans, I.; Breynaert, E.; Poelman, H.; de Gryse, R.; Liang, D.; Van Tendeloo, G.; Maes, A.; Peeters, J.; Jacobs, P. Silica-supported chromium oxide: colloids as building blocks 2007 Physical chemistry, chemical physics 9 8 UA library record; WoS full record; WoS citing articles doi
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