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Author |
Title  |
Year |
Publication |
Volume |
Times cited |
Additional Links |
Links |
|
|
Taylor, P.R.; Martin, J.M.L.; François, J.P.; Gijbels, R. |
An ab initio study of the C3+ cation using multireference methods |
1991 |
The journal of chemical physics |
95 |
|
UA library record |
|
|
|
Lamoen, D.; Persson, B.N.J. |
Adsorption of potassium and oxygen on graphite: a theoretical study |
1998 |
Journal Of Chemical Physics |
108 |
91 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Bafekry, A.; Ghergherehchi, M.; Shayesteh, S.F.; Peeters, F.M. |
Adsorption of molecules on C3N nanosheet : a first-principles calculations |
2019 |
Chemical physics |
526 |
52 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Hamid, I.; Jalali, H.; Peeters, F.M.; Neek-Amal, M. |
Abnormal in-plane permittivity and ferroelectricity of confined water : from sub-nanometer channels to bulk |
2021 |
Journal Of Chemical Physics |
154 |
13 |
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 |
|
|
|
Martin, J.M.L.; François, J.P.; Gijbels, R. |
Ab initio study of the structure, infrared spectra and heat of formation of C4 |
1991 |
The journal of chemical physics |
94 |
62 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Martin, J.M.L.; Taylor, P.R.; François, J.P.; Gijbels, R. |
Ab initio study of the spectroscopy, kinetics, and thermochemistry of the C2N and CN2 molecules |
1994 |
Chemical physics letters |
226 |
46 |
UA library record; WoS full record; WoS citing articles |
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|
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Martin, J.M.L.; Taylor, P.R.; François, J.P.; Gijbels, R. |
Ab initio study of the spectroscopy, kinetics, and thermochemistry of the BN2 molecule |
1994 |
Chemical physics letters |
222 |
14 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Dabral, A.; Lu, A.K.A.; Chiappe, D.; Houssa, M.; Pourtois, G. |
A systematic study of various 2D materials in the light of defect formation and oxidation |
2019 |
Physical chemistry, chemical physics |
21 |
1 |
UA library record; WoS full record; WoS citing articles |
|
|
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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 |
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Momot, A.; Amini, M.N.; Reekmans, G.; Lamoen, D.; Partoens, B.; Slocombe, D.R.; Elen, K.; Adriaensens, P.; Hardy, A.; Van Bael, M.K. |
A novel explanation for the increased conductivity in annealed Al-doped ZnO: an insight into migration of aluminum and displacement of zinc |
2017 |
Physical chemistry, chemical physics |
19 |
26 |
UA library record; WoS full record; WoS citing articles |
|
|
|
Aierken, Y.; Leenaerts, O.; Peeters, F.M. |
A first-principles study of stable few-layer penta-silicene |
2016 |
Physical chemistry, chemical physics |
18 |
42 |
UA library record; WoS full record; WoS citing articles |
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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 |
|
|
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Shirazi, M.; Bogaerts, A.; Neyts, E.C. |
A DFT study of H-dissolution into the bulk of a crystalline Ni(111) surface: a chemical identifier for the reaction kinetics |
2017 |
Physical chemistry, chemical physics |
19 |
10 |
UA library record; WoS full record; WoS citing articles |
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