Showing 1 - 3 results of 3 for search 'Dáire O’Carroll', query time: 0.02s Refine Results
  1. 1
    A DFTB-Based Molecular Dynamics Investigation of an Explicitly Solvated Anatase Nanoparticle

    A DFTB-Based Molecular Dynamics Investigation of an Explicitly Solvated Anatase Nanoparticle by Dáire O’Carroll, Niall J. English

    Published 2022-01-01
    Get full text
    Article
  2. 2
    Multi-Theory Comparisons of Molecular Simulation Approaches to TiO<sub>2</sub>/H<sub>2</sub>O Interfacial Systems

    Multi-Theory Comparisons of Molecular Simulation Approaches to TiO<sub>2</sub>/H<sub>2</sub>O Interfacial Systems by Dáire O’Carroll, Niall J. English

    Published 2023-07-01
    Get full text
    Article
  3. 3
    Self-Diffusion of Individual Adsorbed Water Molecules at Rutile (110) and Anatase (101) TiO<sub>2</sub> Interfaces from Molecular Dynamics

    Self-Diffusion of Individual Adsorbed Water Molecules at Rutile (110) and Anatase (101) TiO<sub>2</sub> Interfaces from Molecular Dynamics by Stephanie J. Boyd, Dáire O’Carroll, Yogeshwaran Krishnan, Run Long, Niall J. English

    Published 2022-03-01
    Get full text
    Article

Search Tools: