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Items where Author is "Michaelides, Angelos"

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Number of items: 4.

2017

Al-Hamdani, Yasmine S. and Michaelides, Angelos and von Lilienfeld, Anatole O.. (2017) Exploring dissociative water adsorption on isoelectronically BN doped graphene using alchemical derivatives. Journal of Chemical Physics, 147 (16). p. 164113.

2016

Al-Hamdani, Yasmine S. and Alfe, Dario and von Lilienfeld, O. Anatole and Michaelides, Angelos. (2016) Tuning dissociation using isoelectronically doped graphene and hexagonal boron nitride: Water and other small molecules. Journal of Chemical Physics, 144 (15). p. 154706.

2015

Al-Hamdani, Yasmine S. and Ma, Ming and Alfè, Dario and von Lilienfeld, O. Anatole and Michaelides, Angelos. (2015) Communication: Water on hexagonal boron nitride from diffusion Monte Carlo. Journal of Chemical Physics, 142 (18). p. 181101.

2014

Al-Hamdani, Yasmine S. and Alfè, Dario and von Lilienfeld, O. Anatole and Michaelides, Angelos. (2014) Water on BN doped benzene: a hard test for exchange-correlation functionals and the impact of exact exchange on weak binding. Journal of Chemical Physics, 141 (18). 18C530.

This list was generated on Fri Mar 29 00:05:29 2024 CET.