Publications [LaTeX]
Papers
International Journals
1 - Exchange-correlation functionals for band gaps of solids: Benchmark, reparametrization and machine learning
P. Borlido, J. Schmidt, A.W. Huran, F. Tran, M.A.L. Marques, and S. Botti
NPJ Comput. Mater. 6, 96 (2020)
2 - Machine Learning the Physical Non-Local Exchange-Correlation Functional of
Density-Functional Theory
J. Schmidt, C.L. Benavides-Riveros, and M.A.L. Marques
J. Phys. Chem. Lett. 10, 6425-6431 (2019)
3 - Representability problem of density functional theory for superconductors
J. Schmidt, C.L. Benavides-Riveros, and M.A.L. Marques
Phys. Rev. B 99, 024502 (2019)
4 - Reduced density matrix functional theory for superconductors
J. Schmidt, C.L. Benavides-Riveros, and M.A.L. Marques
Phys. Rev. B 99, 224502 (2019)
5 - Recent advances and applications of machine learning in solid-state materials science
J. Schmidt, M.R.G. Marques, S. Botti, and M.A.L. Marques
NPJ Comput. Mater. (also appeared in PsiK newsletter, Scientific Highlight of the Month, March) 5, 1-36 (2019)
6 - Predicting the stability of ternary intermetallics with density
functional theory and machine learning
J. Schmidt, L. Chen, S. Botti, and M.A.L. Marques
J. Chem. Phys. 148, 241728 (2018)
7 - Predicting the thermodynamic stability of solids combining density functional theory and machine learning
J. Schmidt, J. Shi, P. Borlido, L. Chen, S. Botti, and M.A.L. Marques
Chem. Mater. 29, 5090-5103 (2017)
Thesis
8 - Reduced Density Matrix Functional
Theory for Superconductors
J. Schmidt
Master thesis, Martin-Luther University of Halle-Wittenberg (2018)
9 - Machine Learning Prediction of the
Stability of Perovskites
J. Schmidt
Bachelor Thesis, Martin-Luther University of Halle-Wittenberg (2016)