Michael Sluydts

Publications

A1 publications

Published

2024

[A1 Publication] How to verify the precision of density-functional-theory implementations via reproducible and universal workflows

Authors

Bosoni E.; Beal L.; Bercx M.; Blaha P.; Blügel S.; Bröder J.; Callsen M.; Cottenier S.; Degomme A.; Dikan V.; Eimre K.; Flage-Larsen E.; Fornari M.; Garcia A.; Genovese L.; Giantomassi M.; Huber S. P.; Janssen H.; Kastlunger G.; Krack M.; Kresse G.; Kühne T. D.; Lejaeghere K.; Madsen G. K. H.; Marsman M.; Marzari N.; Michalicek G.; Mirhosseini H.; Müller T. M. A.; Petretto G.; Pickard C. J.; Poncé S.; Rignanese G.-M.; Rubel O.; Ruh T.; Sluydts M.; Vanpoucke D. E. P.; Vijay S.; Wolloch M.; Wortmann D.; Yakutovich A. V.; Yu J.; Zadoks A.; Zhu B.; Pizzi G.

Nature Reviews Physics 2024. 6(1): 45 - 58. IF: 44.8 1/179 [Q1]

http://dx.doi.org/10.1038/s42254-023-00655-3

2021

[A1 Publication] Race against the Machine: can deep learning recognize microstructures as well as the trained human eye?

Authors

Larmuseau M.; Sluydts M.; Theuwissen K.; Duprez L.; Dhaene T.; Cottenier S.

Scripta Materialia 2021.

https://dx.doi.org/10.1016/j.scriptamat.2020.10.026

2020

[A1 Publication] Compact representations of microstructure images using triplet networks

Authors

Larmuseau M.; Sluydts M.; Theuwissen K.; Duprez L.; Dhaene T.; Cottenier S.

npj Computational Materials 2020.

https://dx.doi.org/10.1038/s41524-020-00423-2

2017

[A1 Publication] Mechanistic Insights in Seeded Growth Synthesis of Colloidal Core/Shell Quantum Dots

Authors

Nakonechnyi I.; Sluydts M.; Justo Y.; Jasieniak J.; Hens Z.

Chemistry of Materials 2017. 29(11): 4719-4727.

http://dx.doi.org/10.1021/acs.chemmater.7b00354

[A1 Publication] High-Throughput Screening of Extrinsic Point Defect Properties in Si and Ge: Database and Applications

Authors

Sluydts M.; Pieters M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

Chemistry of Materials 2017. 29(3): 975 - 984.

http://dx.doi.org/10.1021/acs.chemmater.6b03368

2016

[A1 Publication] Error estimates for density-functional theory predictions of surface energy and work function

Authors

De Waele S.; Lejaeghere K.; Sluydts M.; Cottenier S.

Physical Review B 2016.

https://doi.org/10.1103/PhysRevB.94.235418

[A1 Publication] Ligand Addition Energies and the Stoichiometry of Colloidal Nanocrystals

Authors

Sluydts M.; De Nolf K.; Van Speybroeck V.; Cottenier S.; Hens Z.

ACS Nano 2016. 10(1): 1462-1474. IF: 17.1 12/178 [Q1]

http://dx.doi.org/10.1021/acsnano.5b06965

2015

[A1 Publication] Controlling the Size of Hot Injection Made Nanocrystals by Manipulating the Diffusion Coefficient of the Solute

Authors

De Nolf K.; Capek R. K.; Abé S.; Sluydts M.; Jang Y.; Martins J. C.; Cottenier S.; Lifshitz E.; Hens Z.

Journal of the American Chemical Society 2015. 137(7): 2495 - 2505.

http://dx.doi.org/10.1021/ja509941g

Other publications

Dissertations [MSc and PhD]

PhD thesis

2016

[PhD Thesis] Queue Manager: high-throughput density-functional theory screening software for materials discovery and design

Authors

Sluydts M.

Supervisor(s):

prof. dr. Stefaan Cottenier

prof. dr. ir.

Hens Z.

Doctor of Science: Chemistry, 02/09/2016.

Master thesis

2012

[MSc Thesis] Ligand engineering for colloidal nanocrystals, a molecular modeling approach

Authors

Sluydts M.

Supervisor(s):

prof. dr. ir. Veronique Van Speybroeck

prof. dr. ir.

Hens Z.

Master of Science in Engineering Physics, 2012.

Invited talks [Honorary lectureships, keynotes, plenary talks and invited talks]

Invited talks

2022

[Invited talk] Testing the hell out of DFT codes with virtual oxides

Authors

Cottenier S.; Callsen M.; Lejaeghere K.; Sluydts M.; Ruh T.

19th International Conference on Density Functional Theory and its Applications (DFT2022), Brussels, BE, 28/08/2022 - 02/09/2022

2018

[Invited talk] The road to accuracy: machine-learning-accelerated silicon ab initio simulations

Authors

Sluydts M.; Lauwaert J.; Cottenier S.

Si forum 2018, Okayama, JP, 19/11/2018

[Invited talk] Speeding up materials discovery and design: from high-throughput screening to machine learning

Authors

Sluydts M.; Larmuseau M.; Dumon K.; Crepain T.; Lejaeghere K.; Cottenier S.

MSNANO-18, Faisalabad, PK, 19/02/2018 - 20/02/2018

Talks

2018

[Talk] Accelerating materials screening with machine learning: The case study of silicon

Authors

Sluydts M.; Larmuseau M.; Lauwaert J.; Cottenier S.

34th winter school in theoretical chemistry: Machine Learning in Theoretical Chemistry, Helsinki, FI, 10/12/2018 - 13/12/2018

[Talk] The road to accuracy: machine-learning-accelerated silicon ab initio simulations

Authors

Sluydts M.; Lauwaert J.; Cottenier S.

Okayama University seminar, Okayama, JP, 22/11/2018

[Talk] How many materials are left to discover? An exploration of quaternary space

Authors

Sluydts M.; Larmuseau M.; Crepain T.; Dumon K.; Lejaeghere K.; Cottenier S.

ML4MS 2018 Conference, Espoo, FI, 03/05/2018 - 04/05/2018

2016

[Talk] Ligand Addition Energies and the Stoichiometry of Colloidal Nanocrystals

Authors

Sluydts M.; De Nolf K.; Van Speybroeck V.; Cottenier S.; Hens Z.

EMRS Spring Meeting 2016, Lille, FR, 02/05/2016 - 06/05/2016

[Talk] Ligand Addition Energy and the Stoichiometry of Colloidal Nanocrystals

Authors

De Nolf K.; Sluydts M.; Van Speybroeck V.; Cottenier S.; Hens Z.

2019 MRS (Materials Research Society) Spring Meeting & Exhibit, Phoenix, US, 28/03/2016 - 02/04/2016

2015

[Talk] Tuning Vacancy Trapping by Impurities in Si and Ge by High-Throughput Selection

Authors

Sluydts M.; Pieters M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

8th International Workshop on Modeling in Crystal Growth (IWMCG-8), Spa, BE, 15/11/2015 - 18/11/2015

[Talk] High-throughput screening of extrinsic point defect properties in Si and Ge DFT

Authors

Sluydts M.; Pieters M.; Vanhellemont J.; Van Speybroeck V.

Annual Scientific Meeting of the Belgian Physical Society 2015, Liège, BE, 13/05/2015

[Talk] High-throughput screening of extrinsic point defect properties in Si and Ge

Authors

Sluydts M.; Pieters M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

Euro-TMCS I, Granada, ES, 28/01/2015 - 30/01/2015

2014

[Talk] Ab initio high-throughput study of extrinsic point defect embedding enthalpies in Si and Ge

Authors

Sluydts M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

E-MRS 2014 Spring Meeting, Lille, FR, 26/05/2014 - 30/05/2014

2013

[Talk] Ligand engineering of colloidal nanocrystals

Authors

Sluydts M.; Hens Z.; Van Speybroeck V.; Cottenier S.

14th UGent FEA PhD Symposium , Ghent, BE, 06/12/2013

Posters

2018

[Poster] Machine learning and materials science: ab initio screening to microstructure analysis

Authors

Larmuseau M.; Cools-Ceuppens M.; Sluydts M.; Verstraelen T.; Cottenier S.

34th winter school in theoretical chemistry: Machine Learning in Theoretical Chemistry, Helsinki, FI, 10/12/2018 - 13/12/2018

2017

[Poster] High-Throughput Screening of Extrinsic Point Defect Properties in Si and Ge: Database and Applications

Authors

Sluydts M.; Pieters M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

International Workshop on Machine Learning for Materials Science, Espoo, FI, 08/03/2017 - 09/03/2017

2016

[Poster] Error estimates for density-functional theory predictions of surface energy and work function

Authors

De Waele S.; Lejaeghere K.; Sluydts M.; Cottenier S.

ADIS 2016, Tegernsee, DE, 03/10/2016 - 07/10/2016

[Poster] The High-Throughput approach to Computational Materials Design

Authors

Sluydts M.; Crepain T.; Dumon K.; Van Speybroeck V.; Cottenier S.

General Scientific Meeting 2016 of the Belgian Physical Society, Ghent, BE, 18/05/2016

[Poster] Tuning vacancy trapping by impurities in Si and Ge through high-throughput selection

Authors

Sluydts M.; Pieters M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

EMRS Spring Meeting 2016, Lille, FR, 02/05/2016 - 06/05/2016

2015

[Poster] Hard of soft? Validation of HSAB theory for inorganic ligand adsorption on colloidal nanocrystals

Authors

Sluydts M.; Hens Z.; Van Speybroeck V.; Cottenier S.

Euro-TMCS I, Granada, ES, 28/01/2015 - 30/01/2015

2014

[Poster] Ab initio high-throughput study of extrinsic point defects in Si and Ge

Authors

Sluydts M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

FEA Research Symposium 2014, Ghent, BE, 05/12/2014

[Poster] Ab initio high-throughput study of extrinsic point defects in Si and Ge

Authors

Sluydts M.; Vanhellemont J.; Van Speybroeck V.; Cottenier S.

17th International Conference on Hyperfine Interactions and 21th International Symposium on Nuclear Quadrupole Interactions (HFI/NQI 2014), Canberra, AU, 21/09/2014 - 26/09/2014