The ICE Group

Publications

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  • Currently displaying 141 - 160 of 285 publications
Author(s)
Publication title
Journal Name
Publication year
A blue-sky approach to understanding cloud formation
B Slater, A Michaelides, CG Salzmann, U Lohmann
Bulletin of the American Meteorological Society
(2016)
97
(doi: 10.1175/bams-d-15-00131.1)
Structure of a model TiO2 photocatalytic interface
H Hussain, G Tocci, T Woolcot, X Torrelles, CL Pang, DS Humphrey, CM Yim, DC Grinter, G Cabailh, O Bikondoa, R Lindsay, J Zegenhagen, A Michaelides, G Thornton
Nature Materials
(2016)
16
(doi: 10.1038/NMAT4793)
Nanoscience: Slippery when narrow.
A Michaelides
Nature
(2016)
537
(doi: 10.1038/537171a)
Boosting the accuracy and speed of quantum Monte Carlo: Size consistency and time step
A Zen, S Sorella, MJ Gillan, A Michaelides, D Alfè
Physical Review B
(2016)
93
(doi: 10.1103/physrevb.93.241118)
Preparation, Structure, and Surface Chemistry of Ni–Au Single Atom Alloys
Z-T Wang, MT Darby, AJ Therrien, M El-Soda, A Michaelides, M Stamatakis, ECH Sykes
The Journal of Physical Chemistry C
(2016)
120
(doi: 10.1021/acs.jpcc.6b03473)
Microscopic Mechanism and Kinetics of Ice Formation at Complex Interfaces: Zooming in on Kaolinite.
GC Sosso, T Li, D Donadio, GA Tribello, A Michaelides
J Phys Chem Lett
(2016)
7
(doi: 10.1021/acs.jpclett.6b01013)
Water at Interfaces
O Björneholm, MH Hansen, A Hodgson, L-M Liu, DT Limmer, A Michaelides, P Pedevilla, J Rossmeisl, H Shen, G Tocci, E Tyrode, M-M Walz, J Werner, H Bluhm
Chemical Reviews
(2016)
116
(doi: 10.1021/acs.chemrev.6b00045)
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
(2016)
116
(doi: 10.1021/acs.chemrev.5b00744)
Inverse Temperature Dependence of Nuclear Quantum Effects in DNA Base Pairs.
W Fang, J Chen, M Rossi, Y Feng, X-Z Li, A Michaelides
J Phys Chem Lett
(2016)
7
(doi: 10.1021/acs.jpclett.6b00777)
On Selection of Rotor Support Material for a Ferrite Magnet Spoke-Type Traction Motor
M Kimiabeigi, BC Mecrow, JD Widmer, R Long, Y Gao, J Goss, R Martin, T Lisle, JMS Vizan, A Michaelides
IEEE Transactions on Industry Applications
(2016)
52
(doi: 10.1109/tia.2016.2530722)
Tuning dissociation using isoelectronically doped graphene and hexagonal boron nitride: Water and other small molecules
YS Al-Hamdani, D Alfè, OA von Lilienfeld, A Michaelides
The Journal of chemical physics
(2016)
144
(doi: 10.1063/1.4945783)
Nuclear Quantum Effects in Water and Aqueous Systems: Experiment, Theory, and Current Challenges
M Ceriotti, W Fang, PG Kusalik, RH McKenzie, A Michaelides, MA Morales, TE Markland
Chemical reviews
(2016)
116
(doi: 10.1021/acs.chemrev.5b00674)
The Carbon-Water Interface: Modeling Challenges and Opportunities for the Water-Energy Nexus.
A Striolo, A Michaelides, L Joly
Annual Review of Chemical and Biomolecular Engineering
(2016)
7
(doi: 10.1146/annurev-chembioeng-080615-034455)
Perspective: How good is DFT for water?
MJ Gillan, D Alfè, A Michaelides
The Journal of chemical physics
(2016)
144
(doi: 10.1063/1.4944633)
Strong Coupling between Nanofluidic Transport and Interfacial Chemistry: How Defect Reactivity Controls Liquid–Solid Friction through Hydrogen Bonding
L Joly, G Tocci, S Merabia, A Michaelides
The journal of physical chemistry letters
(2016)
7
(doi: 10.1021/acs.jpclett.6b00280)
Materials modelling in London
D Ciudad
Nat Mater
(2016)
15
(doi: 10.1038/nmat4614)
Can Ice-Like Structures Form on Non-Ice-Like Substrates? The Example of the K‑feldspar Microcline
P Pedevilla, SJ Cox, B Slater, A Michaelides
The journal of physical chemistry. C, Nanomaterials and interfaces
(2016)
120
(doi: 10.1021/acs.jpcc.6b01155)
The interplay of covalency, hydrogen bonding, and dispersion leads to a long range chiral network: The example of 2-butanol
ML Liriano, J Carrasco, EA Lewis, CJ Murphy, TJ Lawton, MD Marcinkowski, AJ Therrien, A Michaelides, ECH Sykes
Journal of Chemical Physics
(2016)
144
(doi: 10.1063/1.4941560)
Controlling Hydrogen Activation, Spillover, and Desorption with Pd-Au Single-Atom Alloys
FR Lucci, MT Darby, MFG Mattera, CJ Ivimey, AJ Therrien, A Michaelides, M Stamatakis, ECH Sykes
J Phys Chem Lett
(2016)
7
(doi: 10.1021/acs.jpclett.5b02400)
Atomic-Scale Picture of the Composition, Decay, and Oxidation of Two-Dimensional Radioactive Films.
A Pronschinske, P Pedevilla, B Coughlin, CJ Murphy, FR Lucci, MA Payne, AJ Gellman, A Michaelides, ECH Sykes
ACS Nano
(2016)
10
(doi: 10.1021/acsnano.5b06640)
Yusuf Hamied Department of Chemistry
Lensfield Road
Cambridge
CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
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