David D. O’Regan

Trinity College Dublin

Ireland

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Articles (7)

Year:

2023

Year:

2023

Year:

2022

Year:

2020

Year:

2020

Year:

2020

Year:

2020

Collaborators (4)

Diana Talia Alvarez Ruiz

The University of Manchester

UNITED KINGDOM

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Nicholas Hine

Professor

University of Warwick

UNITED KINGDOM

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Joseph Prentice

Cooksey Early Career Teaching and Research Fellow

University of Oxford

UNITED KINGDOM

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James Womack

University of Bristol

UNITED KINGDOM

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David D. O’Regan

Research Interests

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Contact this professor

Articles (7)

Dynamical Screening of Local Spin Moments at Metal–Molecule Interfaces

Use of DFT + U + J with linear response parameters to predict non-magnetic oxide band gaps with hybrid-functional accuracy

Adhesion of thin metallic layers on Au surfaces

The ONETEP linear-scaling density functional theory program

Flexing Piezoelectric Diphenylalanine–Plasmonic Metal Nanocomposites to Increase SERS Signal Strength

First-principles Hubbard U and Hund's J corrected approximate density functional theory predicts an accurate fundamental gap in rutile and anatase TiO2

Reproducibility in G<inf>0</inf>W<inf>0</inf> calculations for solids

Collaborators (4)

Diana Talia Alvarez Ruiz

Nicholas Hine

Joseph Prentice

James Womack

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