David O. Scanlon

Publication Activity (10 Years)

Years Active: 2014-2024
Publications (10 Years): 7

Top Topics

Collision Detection

Deformable Surface

Human Resource Management

Top Venues

J. Open Source Softw.

Comput. Phys. Commun.

Publications

Seán R. Kavanagh, Alexander G. Squires, Adair Nicolson, Irea Mosquera-Lois, Alex M. Ganose, Bonan Zhu, Katarina Brlec, Aron Walsh, David O. Scanlon
doped: Python toolkit for robust and repeatable charged defect supercell calculations. J. Open Source Softw. 9 (96) (2024)
Bonan Zhu, Seán R. Kavanagh, David O. Scanlon
easyunfold: A Python package for unfolding electronic band structures. J. Open Source Softw. 9 (94) (2024)
Alexander G. Squires, David O. Scanlon, Benjamin J. Morgan
py-sc-fermi: self-consistent Fermi energies and defect concentrations from electronic structure calculations. J. Open Source Softw. 8 (82) (2023)
Irea Mosquera-Lois, Seán R. Kavanagh, Aron Walsh, David O. Scanlon
ShakeNBreak: Navigating the defect configurational landscape. J. Open Source Softw. 7 (80) (2022)
Katarina Brlec, Daniel W. Davies, David O. Scanlon
Surfaxe: Systematic surface calculations. J. Open Source Softw. 6 (61) (2021)
Adam J. Jackson, Alex M. Ganose, Anna Regoutz, Russel G. Egdell, David O. Scanlon
Galore: Broadening and weighting for simulation of photoelectron spectroscopy. J. Open Source Softw. 3 (26) (2018)
Alex M. Ganose, Adam J. Jackson, David O. Scanlon
sumo: Command-line tools for plotting and analysis of periodic *ab initio* calculations. J. Open Source Softw. 3 (28) (2018)
John Buckeridge, David O. Scanlon, Aron Walsh, C. Richard A. Catlow
Automated procedure to determine the thermodynamic stability of a material and the range of chemical potentials necessary for its formation relative to competing phases and compounds. Comput. Phys. Commun. 185 (1) (2014)