Density-Functional Theory with Screened van der Waals Interactions for the Modeling<? format?> of Hybrid Inorganic-Organic Systems VG Ruiz, W Liu, E Zojer, M Scheffler, A Tkatchenko
Physical review letters 108 (14), 146103, 2012
646 2012 Structure and energetics of benzene adsorbed on transition-metal surfaces: density-functional theory with van der Waals interactions including collective substrate response W Liu, VG Ruiz, GX Zhang, B Santra, X Ren, M Scheffler, A Tkatchenko
New Journal of Physics 15 (5), 053046, 2013
205 2013 Adsorption structures and energetics of molecules on metal surfaces: Bridging experiment and theory RJ Maurer, VG Ruiz, J Camarillo-Cisneros, W Liu, N Ferri, K Reuter, ...
Progress in Surface Science 91 (2), 72-100, 2016
155 2016 Density-functional theory with screened van der Waals interactions applied to atomic and molecular adsorbates on close-packed and non-close-packed surfaces VG Ruiz, W Liu, A Tkatchenko
Physical Review B 93 (3), 035118, 2016
121 2016 Tuning the two-dimensional electron gas at the LaAlO R Arras, VG Ruiz, WE Pickett, R Pentcheva
Physical Review B—Condensed Matter and Materials Physics 85 (12), 125404, 2012
97 2012 Non-additivity of molecule-surface van der Waals potentials from force measurements C Wagner, N Fournier, VG Ruiz, C Li, K Müllen, M Rohlfing, A Tkatchenko, ...
Nature communications 5 (1), 5568, 2014
88 2014 Many-body dispersion effects in the binding of adsorbates on metal surfaces RJ Maurer, VG Ruiz, A Tkatchenko
The Journal of chemical physics 143 (10), 2015
83 2015 Understanding structure and bonding of multilayered metal–organic nanostructures DA Egger, VG Ruiz, WA Saidi, T Bučko, A Tkatchenko, E Zojer
The Journal of Physical Chemistry C 117 (6), 3055-3061, 2013
43 2013 Termination control of electronic phases in oxide thin films and interfaces: LaAlO3 /SrTiO3 (001) R Pentcheva, R Arras, K Otte, VG Ruiz, WE Pickett
Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2012
28 2012 Ion-specific adsorption on bare gold (Au) nanoparticles in aqueous solutions: Double-layer structure and surface potentials Z Li, VG Ruiz, M Kanduc, J Dzubiella
Langmuir 36 (45), 13457-13468, 2020
21 2020 Highly heterogeneous polarization and solvation of gold nanoparticles in aqueous electrolytes Z Li, VG Ruiz, M Kanduc, J Dzubiella
ACS nano 15 (8), 13155-13165, 2021
14 2021 Constructing Binder‐and Carbon Additive‐Free Organosulfur Cathodes Based on Conducting Thiol‐Polymers through Electropolymerization for Lithium‐Sulfur Batteries J Ning, H Yu, S Mei, Y Schütze, S Risse, N Kardjilov, A Hilger, I Manke, ...
ChemSusChem 15 (14), e202200434, 2022
12 2022 Combined first-principles statistical mechanics approach to sulfur structure in organic cathode hosts for polymer based lithium–sulfur (Li–S) batteries Y Schütze, R de Oliveira Silva, J Ning, J Rappich, Y Lu, VG Ruiz, A Bande, ...
Physical Chemistry Chemical Physics 23 (47), 26709-26720, 2021
11 2021 Unexpected termination switching and polarity compensation in G Singh-Bhalla, PB Rossen, GK Pálsson, M Mecklenburg, T Orvis, S Das, ...
Physical Review Materials 2 (11), 112001, 2018
9 2018 How the hydroxylation state of the (110)-rutile TiO 2 surface governs its electric double layer properties S Groh, H Saßnick, VG Ruiz, J Dzubiella
Physical Chemistry Chemical Physics 23 (27), 14770-14782, 2021
7 2021 Accurate quantification of the stability of the perylene-tetracarboxylic dianhydride on Au (111) molecule–surface interface VG Ruiz, C Wagner, F Maaß, HH Arefi, S Stremlau, P Tegeder, FS Tautz, ...
Communications Chemistry 6 (1), 136, 2023
1 2023 Adsorption of atoms and molecules on surfaces: density-functional theory with screened van der Waals interactions VG Ruiz Lopez
Technische Universität Berlin, 2016
1 2016 Molecular Dynamics of the Water-gold Interface including Metal Polarizability Effects in the Classical Force Field V Ruiz, WK Kim, R Roa, J Dzubiella
APS March Meeting Abstracts 2018, E17. 002, 2018
2018 Predictive first-principles modeling of complex inorganic/organic interfaces: PTCDA on Au (111) V Ruiz, A Tkatchenko
APS March Meeting Abstracts 2018, T60. 293, 2018
2018 Quantifying molecule-surface interactions using AFM-based single-molecule manipulation FS Tautz, C Wagner, R Temirov, N Fournier, M Green, T Esat, P Leinen, ...
APS March Meeting Abstracts 2015, L16. 006, 2015
2015 
Alexandre TkatchenkoProfessor of Physics, University of Luxembourg; Visiting Professor, TU Berlin; APS Fellow; FRSCEmail verificata su uni.lu