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Author  |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
Links |
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Dabaghmanesh, S.; Sarmadian, N.; Neyts, E.C.; Partoens, B. |
A first principles study of p-type defects in LaCrO3 |
2017 |
Physical chemistry, chemical physics |
19 |
16 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Dabaghmanesh, S.; Neyts, E.C.; Partoens, B. |
van der Waals density functionals applied to corundum-type sesquioxides : bulk properties and adsorption of CH3 and C6H6 on (0001) surfaces |
2016 |
Physical chemistry, chemical physics |
18 |
6 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Dabaghmanesh, S.; Neek-Amal, M.; Partoens, B.; Neyts, E.C. |
The formation of Cr2O3 nanoclusters over graphene sheet and carbon nanotubes |
2017 |
Chemical physics letters |
687 |
2 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Colomer, J.F.; Stephan, C.; Lefrant, S.; Van Tendeloo, G.; Willems, I.; Konya, Z.; Fonseca, A.; Laurent, C.; Nagy, J.B. |
Large-scale synthesis of single-wall carbon nanotubes by catalytic chemical vapor deposition (CCVD) method |
2000 |
Chemical physics letters |
317 |
344 |
UA library record; WoS full record; WoS citing articles |
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Colomer, J.-F.; Benoit, J.-M.; Stephan, C.; Lefrant, S.; Van Tendeloo, G.; Nagy, J.B. |
Characterization of single-wall carbon nanotubes produced by CCVD method |
2001 |
Chemical physics letters |
345 |
45 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Chaney, G.; Cakir, D.; Peeters, F.M.; Ataca, C. |
Stability of adsorption of Mg and Na on sulfur-functionalized MXenes |
2021 |
Physical Chemistry Chemical Physics |
23 |
3 |
UA library record; WoS full record; WoS citing articles |
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|
Calizzi, M.; Venturi, F.; Ponthieu, M.; Cuevas, F.; Morandi, V.; Perkisas, T.; Bals, S.; Pasquini, L. |
Gas-phase synthesis of Mg-Ti nanoparticles for solid-state hydrogen storage |
2016 |
Physical chemistry, chemical physics |
18 |
31 |
UA library record; WoS full record; WoS citing articles |
|
|
|
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 |
|
|
|
Çakir, D.; Peeters, F.M. |
Fluorographane : a promising material for bipolar doping of MoS2 |
2015 |
Physical chemistry, chemical physics |
17 |
7 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Çakir, D.; Kecik, D.; Sahin, H.; Durgun, E.; Peeters, F.M. |
Realization of a p-n junction in a single layer boron-phosphide |
2015 |
Physical chemistry, chemical physics |
17 |
104 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Cai, Z.L.; Martin, J.M.L.; François, J.P.; Gijbels, R. |
Ab initio study of the X2\Sigma+ and A 2\Pi states of the SiN radical |
1996 |
Chemical physics letters |
252 |
28 |
UA library record; WoS full record; WoS citing articles |
|
|
|
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 |
|
|
|
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 |
|
|
|
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 |
|
|
|
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 |
|
|
|
Bittencourt, C.; Felten, A.; Ghijsen, J.; Pireaux, J.-J.; Drube, W.; Erni, R.; Van Tendeloo, G. |
Decorating carbon nanotubes with nickel nanoparticles |
2007 |
Chemical physics letters |
436 |
78 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Bercx, M.; Sarmadian, N.; Saniz, R.; Partoens, B.; Lamoen, D. |
First-principles analysis of the spectroscopic limited maximum efficiency of photovoltaic absorber layers for CuAu-like chalcogenides and silicon |
2016 |
Physical chemistry, chemical physics |
18 |
34 |
UA library record; WoS full record; WoS citing articles |
|
|
|
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 |
|
|
|
Baskurt, M.; Yagmurcukardes, M.; Peeters, F.M.; Sahin, H. |
Stable single-layers of calcium halides (CaX₂, X = F, Cl, Br, I) |
2020 |
Journal Of Chemical Physics |
152 |
10 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Baskurt, M.; Nair, R.R.; Peeters, F.M.; Sahin, H. |
Ultra-thin structures of manganese fluorides : conversion from manganese dichalcogenides by fluorination |
2021 |
Physical Chemistry Chemical Physics |
23 |
1 |
UA library record; WoS full record; WoS citing articles |
|
|
|
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 |
|
|
|
Bal, K.M.; Neyts, E.C. |
Modelling molecular adsorption on charged or polarized surfaces: a critical flaw in common approaches |
2018 |
Physical chemistry, chemical physics |
20 |
8 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Bal, K.M.; Neyts, E.C. |
Extending and validating bubble nucleation rate predictions in a Lennard-Jones fluid with enhanced sampling methods and transition state theory |
2022 |
Journal Of Chemical Physics |
157 |
|
UA library record; WoS full record; WoS citing articles |
|
|
|
Bal, K.M.; Fukuhara, S.; Shibuta, Y.; Neyts, E.C. |
Free energy barriers from biased molecular dynamics simulations |
2020 |
Journal Of Chemical Physics |
153 |
|
UA library record; WoS full record; WoS citing articles |
|
|
|
Bal, K.M. |
Nucleation rates from small scale atomistic simulations and transition state theory |
2021 |
Journal Of Chemical Physics |
155 |
|
UA library record; WoS full record; WoS citing articles |
|
|
|
Bafekry, A.; Yagmurcukardes, M.; Akgenc, B.; Ghergherehchi, M.; Mortazavi, B. |
First-principles investigation of electronic, mechanical and thermoelectric properties of graphene-like XBi (X = Si, Ge, Sn) monolayers |
2021 |
Physical Chemistry Chemical Physics |
23 |
|
UA library record; WoS full record; WoS citing articles |
|
|
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Bafekry, A.; Stampfl, C.; Akgenc, B.; Mortazavi, B.; Ghergherehchi, M.; Nguyen, C.V. |
Embedding of atoms into the nanopore sites of the C₆N₆ and C₆N₈ porous carbon nitride monolayers with tunable electronic properties |
2020 |
Physical Chemistry Chemical Physics |
22 |
17 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Bafekry, A.; Stampfl, C.; Akgenc, B.; Ghergherehchi, M. |
Control of C3N4 and C4N3 carbon nitride nanosheets' electronic and magnetic properties through embedded atoms |
2020 |
Physical Chemistry Chemical Physics |
22 |
18 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Bafekry, A.; Shayesteh, S.F.; Peeters, F.M. |
Introducing novel electronic and magnetic properties in C3N nanosheets by defect engineering and atom substitution |
2019 |
Physical chemistry, chemical physics |
21 |
52 |
UA library record; WoS full record; WoS citing articles |
|
|
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Bafekry, A.; Karbasizadeh, S.; Stampfl, C.; Faraji, M.; Hoat, D.M.; Sarsari, I.A.; Feghhi, S.A.H.; Ghergherehchi, M. |
Two-dimensional Janus semiconductor BiTeCl and BiTeBr monolayers : a first-principles study on their tunable electronic properties via an electric field and mechanical strain |
2021 |
Physical Chemistry Chemical Physics |
23 |
|
UA library record; WoS full record; WoS citing articles |
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