|
1.
|
“Theoretical
Insights into the Structural and Electronic Properties of First-Row
Transition Metal-Doped In2O3 Systems”, L. Meng, F. Viñes,
F. Illas, submitted for publication
|
|
2.
|
“Accurate
Prediction of Adsorption and Diffusion Energies of Single Metal Atoms
Supported on MXenes from Machine Learning”, D. Dolz,
S. Pibernat, Á. Morales-García, F. Viñes, F. Illas, submitted for publication
|
|
3.
|
“Predicting
the HER Activity of SACs on MXenes with Simple Features and Interpretable
Machine Learning Models”, C. Chowdhury, M. Lovato, G. Di Liberto, F.c Viñes, F. Illas, G. Pacchioni, L. Giordano, submitted
for publication
|
|
4.
|
“Selective
Hydrodemethylation of Methyl Alkylbenzenes on KH/C”, P. Tian, M.
Figueras-Valls, F. Chang, F. Viñes, F. Illas, A.
Fedorov, submitted for publication
|