Publications of Lucas Foppa

Journal Article (12)

2025
Journal Article
Bellini, Giulia, Gregor Koch, Frank Girgsdies, Jinhu Dong, Spencer Carey, Olaf Timpe, Gudrun Auffermann, Matthias Scheffler, Robert Schlögl, Lucas Foppa and Annette Trunschke: CO Oxidation Catalyzed by Perovskites: The Role of Crystallographic Distortions Highlighted by Systematic Experiments and Artificial Intelligence.
MPG.PuRe
DOI
Full
publisher-version
Journal Article
Rivera-Arrieta, Herzain I. and Lucas Foppa: Rules Describing CO2 Activation on Single-Atom Alloys from DFT-Meta-GGA Calculations and Artificial Intelligence.
MPG.PuRe
DOI
pre-print
publisher-version
2024
Journal Article
Bauer, Stefan, Peter Benner, Tristan Bereau, Volker Blum, Mario Boley, Christian Carbogno, C.Richard A. Catlow, Gerhard Dehm, Sebastian Eibl, Ralph Ernstorfer, Adam Fekete, Lucas Foppa, Peter Fratzl, Christoph Freysoldt, Baptiste Gault, Luca M. Ghiringhelli, Sajal K. Giri, Anton Gladyshev, Pawan Goyal, Jason Hattrick-Simpers, Lara Kabalan, Petr Karpov, Mohammad S. Khorrami, Christoph Koch, Sebastian Kokott, Thomas Kosch, Igor Kowalec, Kurt Kremer, Andreas Leitherer, Yue Li, Christian H. Liebscher, Andrew J. Logsdail, Zhongwei Lu, Felix Luong, Andreas Marek, Florian Merz, Jaber R. Mianroodi, Jorg Neugebauer, Zongrui Pei, Thomas Purcell, Dierk Raabe, Markus Rampp, Mariana Rossi, Jan-Michael Rost, James E. Saal, Ulf Saalmann, Kasturi Narasimha Sasidhar, Alaukik Saxena, Luigi Sbailo, Markus Scheidgen, Marcel Schloz, Daniel F. Schmidt, Simon Teshuva, Annette Trunschke, Ye Wei, Gerhard Weikum, R.Patrick Xian, Yi Yao, Junqi Yin, Meng Zhao and Matthias Scheffler: Roadmap on data-centric materials science.
MPG.PuRe
DOI
pre-print
publisher-version
Journal Article
Miyazaki, Ray, Kendra S. Belthle, Harun Tüysüz, Lucas Foppa and Matthias Scheffler: Materials Genes of CO2 Hydrogenation on Supported Cobalt Catalysts: An Artificial Intelligence Approach Integrating Theoretical and Experimental Data.
MPG.PuRe
DOI
publisher-version
Journal Article
Miyazaki, Ray, Somayeh Faraji, Sergey V. Levchenko, Lucas Foppa and Matthias Scheffler: Vibrational frequencies utilized for the assessment of exchange-correlation functionals in the description of metal-adsorbate systems: C2H2 and C2H4 on transition-metal surfaces.
MPG.PuRe
DOI
pre-print
publisher-version
2023
Journal Article
Foppa, Lucas, Rüther Frederik, Michael Geske, Gregor Koch, Frank Girgsdies, Pierre Kube, Spencer Carey, Michael Hävecker, Olaf Timpe, Andrey Tarasov, Matthias Scheffler, Frank Rosowski, Robert Schlögl and Annette Trunschke: Data-Centric Heterogeneous Catalysis: Identifying Rules and Materials Genes of Alkane Selective Oxidation.
MPG.PuRe
DOI
publisher-version
2022
Journal Article
Belthle, Kendra S., Tuğçe Beyazay, Cristina Ochoa-Hernández, Ray Miyazaki, Lucas Foppa, William F. Martin and Harun Tüysüz: Effects of Silica Modification (Mg, Al, Ca, Ti, and Zr) on Supported Cobalt Catalysts for H2-Dependent CO2 Reduction to Metabolic Intermediates.
MPG.PuRe
DOI
publisher-version
Journal Article
Foppa, Lucas and Luca M. Ghiringhelli: Identifying Outstanding Transition‑Metal‑Alloy Heterogeneous Catalysts for the Oxygen Reduction and Evolution Reactions via Subgroup Discovery.
MPG.PuRe
DOI
pre-print
publisher-version
Journal Article
Foppa, Lucas, Thomas Purcell, Sergey V. Levchenko, Matthias Scheffler and Luca M. Ghiringhelli: Hierarchical Symbolic Regression for Identifying Key Physical Parameters Correlated with Bulk Properties of Perovskites.
MPG.PuRe
DOI
publisher-version
Journal Article
Foppa, Lucas, Christopher A. Sutton, Luca M. Ghiringhelli, Sandip De, Patricia Löser, Stephan A. Schunk, Ansgar Schäfer and Matthias Scheffler: Learning Design Rules for Selective Oxidation Catalysts from High-Throughput Experimentation and Artificial Intelligence.
MPG.PuRe
DOI
publisher-version
2021
Journal Article
Foppa, Lucas, Luca M. Ghiringhelli, Frank Girgsdies, Maike Hashagen, Pierre Kube, Michael Hävecker, Spencer Carey, Andrey Tarasov, Peter Kraus, Frank Rosowski, Robert Schlögl, Annette Trunschke and Matthias Scheffler: Materials genes of heterogeneous catalysis from clean experiments and artificial intelligence.
MPG.PuRe
DOI
pre-print
publisher-version
2020
Journal Article
MPG.PuRe
DOI
publisher-version

Talk (33)

2024
Talk
Foppa, Lucas: AI-Model-Driven Optimization of Materials Properties: Challenges and Application to Catalyst Discovery.
(Symposium for the Max-Planck-Cardiff Centre on the Fundamentals of Heterogeneous Catalysis (FUNCAT), Cardiff, UK, Apr 2024).
MPG.PuRe
Talk
Foppa, Lucas: Learning Design Rules for Heterogeneous Catalysts via Artificial Intelligence.
(Surface Science Discussions 2024, Online Event, Jan 2024).
MPG.PuRe
Talk
Foppa, Lucas: Learning Design Rules for Heterogeneous Catalysis via AI.
(Chemistry Colloquium, Universidad Jaume I, Castellon, Spain, May 2024).
MPG.PuRe
Talk
Foppa, Lucas: Learning Rules for Materials Design via AI.
(Workshop, Future of Materials Discovery, University College London, London, UK, Jun 2024).
MPG.PuRe
Talk
Foppa, Lucas: Identifying Rules Describing Materials Properties and Functions via Tailored Artificial Intelligence.
(Theoretical Chemistry Colloquium, Freie Universität Berlin, Berlin, Germany, Jun 2024).
MPG.PuRe
Talk
Foppa, Lucas: Learning Rules for Catalyst Design via Artificial Intelligence.
(1st International CCSS Workshop, Ruhr-Universität Bochum, Bochum, Germany, Aug 2024).
MPG.PuRe
Talk
Foppa, Lucas: From Prediction to Action: Critical Role of Performance Estimation for Machine-Learning-Driven Materials Discovery.
(Meeting on Mathematics and Computer Science for Materials Innovation, MACSMIN 2024, University of Liverpool, Liverpool, UK, Sep 2024).
MPG.PuRe
Talk
Foppa, Lucas: Describing Materials Properties and Functions via the Materials Genes Concept.
(International Workshop on Data-Driven Computational and Theoretical Materials Design, Shanghai, China, Oct 2024).
MPG.PuRe
Web-View
Print Page
Open in new window
Estimated DIN-A4 page-width
Go to Editor View