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Alfredo Pasquarello

3 results in Authors: Alfredo Pasquarello

Theoretical and Computational Chemistry

On the Electronic and Optical Properties of Metal-Organic Frameworks: Case Study of MIL-125 and MIL-125-NH2

Gloria Capano, Francesco Ambrosio, Stavroula Kampouri, Kyriakos Stylianou, Alfredo Pasquarello, Berend Smit

Version 1 posted 21 January 2020

2,288

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Oxygen evolution at the BiVO4-water interface: Mechanism of the water dehydrogenation reaction

Sai Lyu, Julia Wiktor, Alfredo Pasquarello

Version 1 posted 08 September 2022

350

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Theoretical and Computational Chemistry

Evolution of Aqueous Electron with Varying Temperature

Jinggang Lan, Vladimir V. Rybkin, Alfredo Pasquarello

Version 2 posted 21 June 2022

400

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