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Aron Walsh
ORCID
Publication Activity (10 Years)
Years Active: 2012-2024
Publications (10 Years): 9
Top Topics
Neural Network
Prediction Accuracy
Space Filling Curves
Quality Prediction
Top Venues
J. Open Source Softw.
CoRR
Comput. Phys. Commun.
Nat. Comput. Sci.
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Publications
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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)
Hannah Janmohamed
,
Marta Wolinska
,
Shikha Surana
,
Thomas Pierrot
,
Aron Walsh
,
Antoine Cully
Multi-Objective Quality-Diversity for Crystal Structure Prediction.
GECCO
(2024)
Marta Wolinska
,
Aron Walsh
,
Antoine Cully
Illuminating the property space in crystal structure prediction using Quality-Diversity algorithms.
CoRR
(2024)
Hannah Janmohamed
,
Marta Wolinska
,
Shikha Surana
,
Thomas Pierrot
,
Aron Walsh
,
Antoine Cully
Multi-Objective Quality-Diversity for Crystal Structure Prediction.
CoRR
(2024)
Alexander Moriarty
,
Kazuki Morita
,
Keith T. Butler
,
Aron Walsh
UnlockNN: Uncertainty quantification for neural network models of chemical systems.
J. Open Source Softw.
7 (75) (2022)
Shanshan Wang
,
Menglin Huang
,
Yu-Ning Wu
,
Weibin Chu
,
Jin Zhao
,
Aron Walsh
,
Xin-Gao Gong
,
Suhuai Wei
,
Shiyou Chen
Effective lifetime of non-equilibrium carriers in semiconductors from non-adiabatic molecular dynamics simulations.
Nat. Comput. Sci.
2 (8) (2022)
Irea Mosquera-Lois
,
Seán R. Kavanagh
,
Aron Walsh
,
David O. Scanlon
ShakeNBreak: Navigating the defect configurational landscape.
J. Open Source Softw.
7 (80) (2022)
Sunghyun Kim
,
Samantha Hood
,
Puck van Gerwen
,
Lucy D. Whalley
,
Aron Walsh
CarrierCapture.jl: Anharmonic Carrier Capture.
J. Open Source Softw.
5 (47) (2020)
Daniel W. Davies
,
Keith Butler
,
Adam J. Jackson
,
Jonathan Skelton
,
Kazuki Morita
,
Aron Walsh
SMACT: Semiconducting Materials by Analogy and Chemical Theory.
J. Open Source Softw.
4 (38) (2019)
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)
Asimina Maniopoulou
,
Erlend R. M. Davidson
,
Ricardo Grau-Crespo
,
Aron Walsh
,
Ian J. Bush
,
C. Richard A. Catlow
,
Scott M. Woodley
Introducing k-point parallelism into VASP.
Comput. Phys. Commun.
183 (8) (2012)