Mikołaj Martyka

8PUBLICATIONS
15CO-AUTHORS
Theoretical quantum chemistryDeep learningPhotonics, optoelectronics and optical communicationsComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Nanoelectromechanical systems
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Publications (8)

|Sep 24, 2026
A data-efficient machine-learning approach for modeling the photodynamics of all-trans hexatriene based on multireference configuration interaction calculations.

|Sep 24, 2026
Active delta-learning for surface hopping: efficient fitting of potential energy surfaces.

|Apr 07, 2026
OMNI-P2x universal neural network potential for excited-state simulations.

Mikołaj Martyka, Xin-Yu Tong, Joanna Jankowska

|Feb 18, 2026
Flexible Framework for Surface Hopping: From Hybrid Schemes for Machine Learning to Benchmarkable Nonadiabatic Dynamics.

Jakub Martinka, Mikołaj Martyka, Biman Medhi

|Nov 03, 2025
A Descriptor Is All You Need: Accurate Machine Learning of Nonadiabatic Coupling Vectors.

Jakub Martinka, Lina Zhang, Yi-Fan Hou

|Feb 27, 2025
Polarized molecular wires for efficient photo-generation of free electric charge carriers.

Mikołaj Martyka, Joanna Jankowska

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Frequent Collaborators

5 joint publications

Pavlo O Dral

4 joint publications

Joanna Jankowska

2 joint publications

Jakub Martinka

2 joint publications

Jiří Pittner