Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
Nikolaev, A.V.; Lamoen, D.; Partoens, B. |
Extension of the basis set of linearized augmented plane wave (LAPW) method by using supplemented tight binding basis functions |
2016 |
The journal of chemical physics |
145 |
11 |
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 |
Payne, L.M.; Masia, F.; Zilli, A.; Albrecht, W.; Borri, P.; Langbein, W. |
Quantitative morphometric analysis of single gold nanoparticles by optical extinction microscopy: Material permittivity and surface damping effects |
2021 |
Journal Of Chemical Physics |
154 |
|
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 |
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 |
Nikolaev, A.V.; Prassides, K.; Michel, K.H. |
Charge transfer and polymer phases in AC60 (A=K, Rb, Cs) fullerides |
1998 |
The journal of chemical physics |
108 |
14 |
UA library record; WoS full record; WoS citing articles |
Lamoen, D.; Michel, K.H. |
Crystal field, orientational order, and lattice contraction in solid C60 |
1994 |
The journal of chemical physics |
101 |
39 |
UA library record; WoS full record; WoS citing articles |
Verberck, B.; Michel, K.H.; Nikolaev, A.V. |
Crystal structures of polymerized fullerides AC60, A=K, Rb, Cs, and alkali-mediated interactions |
2002 |
The journal of chemical physics |
116 |
12 |
UA library record; WoS full record; WoS citing articles |
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 |
Martin, J.M.L.; François, J.P.; Gijbels, R. |
First principles computation of thermo-chemical properties beyond the harmonic approximation: 1: method and application to the water molecule and its isotopomers |
1992 |
The journal of chemical physics |
96 |
59 |
UA library record; WoS full record; WoS citing articles |
Martin, J.M.L.; François, J.P.; Gijbels, R. |
First principles computation of thermo-chemical properties beyond the harmonic approximation: 2: application to the amino radical and its isotopomers |
1992 |
The journal of chemical physics |
97 |
22 |
UA library record; WoS full record; WoS citing articles |
Michel, K.H. |
Molecular structure and orientational ordering in solid C60 |
1992 |
The journal of chemical physics |
97 |
20 |
UA library record; WoS full record; WoS citing articles |
Martin, J.M.L.; François, J.P.; Gijbels, R. |
On the effect of centrifugal stretching on the rotational partition function of an asymmetric top |
1991 |
The journal of chemical physics |
95 |
12 |
UA library record; WoS full record; WoS citing articles |
Martin, J.M.L.; François, J.P.; Gijbels, R. |
On the heat formation of C8 and higher carbon clusters (letter to the editor) |
1991 |
The journal of chemical physics |
95 |
27 |
UA library record; WoS full record; WoS citing articles |
Proost, J.; Blaffart, F.; Turner, S.; Idrissi, H. |
On the Origin of Damped Electrochemical Oscillations at Silicon Anodes (Revisited) |
2014 |
ChemPhysChem : a European journal of chemical physics and physical chemistry |
15 |
5 |
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 |
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 |
Armelao, L.; Barreca, D.; Bottaro, G.; Gasparotto, A.; Maccato, C.; Tondello, E.; Lebedev, O.I.; Turner, S.; Van Tendeloo, G.; Štangar, U.L. |
Rational design of Ag/TiO2 nanosystems by a combined RF-sputtering/sol-gel approach |
2009 |
ChemPhysChem : a European journal of chemical physics and physical chemistry |
10 |
56 |
UA library record; WoS full record; WoS citing articles |
Felten, A.; Suarez-Martinez, I.; Ke, X.; Van Tendeloo, G.; Ghijsen, J.; Pireaux, J.-J.; Drube, W.; Bittencourt, C.; Ewels, C.P. |
The role of oxygen at the interface between titanium and carbon nanotubes |
2009 |
ChemPhysChem : a European journal of chemical physics and physical chemistry |
10 |
38 |
UA library record; WoS full record; WoS citing articles |
Titantah, J.T.; Pierleoni, C.; Ryckaert, J.-P. |
Single chain elasticity and thermoelasticity of polyethylene |
2002 |
The journal of chemical physics |
117 |
5 |
UA library record; WoS full record; WoS citing articles |
Bittencourt, C.; van Lier, G.; Ke, X.; Suarez-Martinez, I.; Felten, A.; Ghijsen, J.; Van Tendeloo, G.; Ewels, C.O. |
Spectroscopy and defect identification for fluorinated carbon nanotubes |
2009 |
ChemPhysChem : a European journal of chemical physics and physical chemistry |
10 |
14 |
UA library record; WoS full record; WoS citing articles |
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 |
Nikolaev, A.V.; Michel, K.H. |
Superexchange and electron correlations in alkali fullerides AC60, A=K, Rb, Cs |
2005 |
The journal of chemical physics |
122 |
11 |
UA library record; WoS full record; WoS citing articles |
Michel, K.H.; Verberck, B.; Hulman, M.; Kuzmany, H.; Krause, M. |
Superposition of quantum and classical rotational motions in Sc2C2@C84 fullerite |
2007 |
The journal of chemical physics |
126 |
14 |
UA library record; WoS full record; WoS citing articles |
Leys, F.E.; March, N.H.; Lamoen, D. |
Thermodynamic consistency and integral equations for the liquid structure |
2002 |
Journal Of Chemical Physics |
117 |
|
UA library record; WoS full record; |
Verberck, B.; Popov, V.N.; Nikolaev, A.V.; Lamoen, D. |
Valence electronic charge density of distorted C60-monomers in polymerized KC60 and RbC60 |
2004 |
The journal of chemical physics |
121 |
7 |
UA library record; WoS full record; WoS citing articles |
Cornil, D.; Li, H.; Wood, C.; Pourtois, G.; Bredas, J.-L.; Cornil, J. |
Work-function modification of Au and Ag surfaces upon deposition of self-assembled monolayers : influence of the choice of the theoretical approach and the thiol decomposition scheme |
2013 |
ChemPhysChem : a European journal of chemical physics and physical chemistry |
14 |
9 |
UA library record; WoS full record; WoS citing articles |
Bekermann, D.; Gasparotto, A.; Barreca, D.; Devi, A.; Fischer, R.A.; Kete, M.; Štangar, U.L.; Lebedev, O.I.; Maccato, C.; Tondello, E.; Van Tendeloo, G. |
ZnO nanorod arrays by plasma-enhanced CVD for light-activated functional applications |
2010 |
ChemPhysChem : a European journal of chemical physics and physical chemistry |
11 |
38 |
UA library record; WoS full record; WoS citing articles |
Iyikanat, F.; Senger, R.T.; Peeters, F.M.; Sahin, H. |
Quantum-Transport Characteristics of a p-n Junction on Single-Layer TiS3 |
2016 |
ChemPhysChem : a European journal of chemical physics and physical chemistry |
17 |
12 |
UA library record; WoS full record; WoS citing articles |