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Co-authors
Philipp Rüßmann
PostDoc Forschungszentrum Jülich
Verified email at fz-juelich.de
Stefan Blügel
Peter Grünberg Institut and Institute for Advanced Simulation
Verified email at max-centre.eu
Ira Assent
Professor of Computer Science, Aarhus University, Denmark; IAS-8, Forschungszentrum Jülich
Verified email at cs.au.dk
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Johannes Wasmer
PhD student,
Forschungszentrum Jülich
Verified email at fz-juelich.de -
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density functional theory
machine learning
quantum materials
AI for science
open science
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Year
Benchmark study of symmetry-adapted ML-DFT models for magnetically doped topological insulators
J Wasmer, I Assent, R Mozumder, S Blügel, P Rüssmann
DPG SKM 2023
, 2022
2022
Comparison of structural representations for machine learning-enhanced DFT of impurity embeddings
J Wasmer, S Blügel, P Rüssmann
Virtual Materials Design 2021
, 2022
2022
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