Articles with public access mandates - Angelos MichaelidesLearn more
Not available anywhere: 1
Tracking single adatoms in liquid in a transmission electron microscope
N Clark, DJ Kelly, M Zhou, YC Zou, CW Myung, DG Hopkinson, C Schran, ...
Nature 609 (7929), 942-947, 2022
Mandates: National Natural Science Foundation of China, UK Engineering and Physical …
Available somewhere: 148
Crystal nucleation in liquids: Open questions and future challenges in molecular dynamics simulations
GC Sosso, J Chen, SJ Cox, M Fitzner, P Pedevilla, A Zen, A Michaelides
Chemical reviews 116 (12), 7078-7116, 2016
Mandates: European Commission
Water at interfaces
O Björneholm, MH Hansen, A Hodgson, LM Liu, DT Limmer, ...
Chemical reviews 116 (13), 7698-7726, 2016
Mandates: US Department of Energy, Swedish Research Council, European Commission
Perspective: How good is DFT for water?
MJ Gillan, D Alfe, A Michaelides
The Journal of chemical physics 144 (13), 2016
Mandates: US Department of Energy, UK Engineering and Physical Sciences Research …
A molecular perspective of water at metal interfaces
J. Carrasco, A. Hodgson and A. Michaelides
Nature Materials 11, 667, 2012
Mandates: Government of Spain
Nuclear quantum effects in water and aqueous systems: Experiment, theory, and current challenges
M Ceriotti, W Fang, PG Kusalik, RH McKenzie, A Michaelides, ...
Chemical reviews 116 (13), 7529-7550, 2016
Mandates: US Department of Energy, Swiss National Science Foundation, Natural Sciences …
Pt/Cu single-atom alloys as coke-resistant catalysts for efficient C–H activation
MD Marcinkowski, MT Darby, J Liu, JM Wimble, FR Lucci, S Lee, ...
Nature chemistry 10 (3), 325-332, 2018
Mandates: US Department of Energy, UK Engineering and Physical Sciences Research …
Ice nanoclusters at hydrophobic metal surfaces
A Michaelides, K Morgenstern
Nature materials 6 (8), 597-601, 2007
Mandates: German Research Foundation
Friction of Water on Graphene and Hexagonal Boron Nitride from Ab Initio Methods: Very Different Slippage Despite Very Similar Interface Structures
G Tocci, L Joly, A Michaelides
Nano letters 14 (12), 6872-6877, 2014
Mandates: UK Engineering and Physical Sciences Research Council, European Commission
Atomistic details of oxide surfaces and surface oxidation: the example of copper and its oxides
C Gattinoni, A Michaelides
Surface Science Reports 70 (3), 424-447, 2015
Mandates: European Commission
Benzene adsorbed on metals: Concerted effect of covalency and van der Waals bonding
W Liu, J Carrasco, B Santra, A Michaelides, M Scheffler, A Tkatchenko
Physical Review B—Condensed Matter and Materials Physics 86 (24), 245405, 2012
Mandates: Government of Spain
Active sites in heterogeneous ice nucleation—the example of K-rich feldspars
A Kiselev, F Bachmann, P Pedevilla, SJ Cox, A Michaelides, D Gerthsen, ...
Science 355 (6323), 367-371, 2017
Mandates: German Research Foundation, Helmholtz Association, UK Engineering and …
Adsorption and diffusion of water on graphene from first principles
J Ma, A Michaelides, D Alfe, L Schimka, G Kresse, E Wang
Physical Review B—Condensed Matter and Materials Physics 84 (3), 033402, 2011
Mandates: Austrian Science Fund
Structure of a model TiO2 photocatalytic interface
H Hussain, G Tocci, T Woolcot, X Torrelles, CL Pang, DS Humphrey, ...
Nature materials 16 (4), 461-466, 2017
Mandates: UK Engineering and Physical Sciences Research Council, European Commission …
Lonely atoms with special gifts: breaking linear scaling relationships in heterogeneous catalysis with single-atom alloys
MT Darby, M Stamatakis, A Michaelides, ECH Sykes
The journal of physical chemistry letters 9 (18), 5636-5646, 2018
Mandates: US Department of Energy, UK Engineering and Physical Sciences Research …
The many faces of heterogeneous ice nucleation: Interplay between surface morphology and hydrophobicity
M Fitzner, GC Sosso, SJ Cox, A Michaelides
Journal of the American Chemical Society 137 (42), 13658-13669, 2015
Mandates: UK Engineering and Physical Sciences Research Council, European Commission
First-principles design of a single-atom–alloy propane dehydrogenation catalyst
RT Hannagan, G Giannakakis, R Réocreux, J Schumann, J Finzel, ...
Science 372 (6549), 1444-1447, 2021
Mandates: US National Science Foundation, US Department of Energy, UK Engineering and …
Two dimensional ice from first principles: Structures and phase transitions
J Chen, G Schusteritsch, CJ Pickard, CG Salzmann, A Michaelides
Physical review letters 116 (2), 025501, 2016
Mandates: UK Engineering and Physical Sciences Research Council, European Commission
Controlling hydrogen activation, spillover, and desorption with Pd–Au single-atom alloys
FR Lucci, MT Darby, MFG Mattera, CJ Ivimey, AJ Therrien, A Michaelides, ...
The journal of physical chemistry letters 7 (3), 480-485, 2016
Mandates: US Department of Energy, UK Engineering and Physical Sciences Research …
The role of van der Waals forces in water adsorption on metals
J Carrasco, J Klimeš, A Michaelides
The Journal of chemical physics 138 (2), 2013
Mandates: Government of Spain
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