Instytut Podstawowych Problemów Techniki
Polskiej Akademii Nauk

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Rafał Jakieła


Ostatnie publikacje
1.  Demchenko I. N.♦, Shokri A.♦, Syryanyy Y.♦, Melikhov Y., Chernyshova M.♦, Turek M.♦, Droździel A.♦, Munnik F.♦, Jakieła R.♦, Minikayev R.♦, Domagala J. Z.♦, Derkachova A.♦, Zaja̧c M.♦, Krajczewski J.♦, Grzanka E.♦, Galazka Z.♦, Dopant Molecularization in β-Ga2O3: Formation of N2 under Nonequilibrium Conditions, Journal of Physical Chemistry Letters , ISSN: 1948-7185, DOI: 10.1021/acs.jpclett.6c01536, Vol.17, No.29, pp.8232-8239, 2026

Streszczenie:
The microscopic fate of dopants introduced under nonequilibrium conditions remains largely unresolved in wide-band gap oxides. Using temperature-dependent N K-edge X-ray absorption spectroscopy, we directly resolve the local bonding configuration of implanted nitrogen in (100) β-Ga2O3. The spectra are dominated by a sharp π* resonance characteristic of N≡N bonding that systematically intensifies upon annealing, providing a direct spectroscopic fingerprint of molecular nitrogen formation. First-principles calculations and multiple-scattering simulations reproduce these spectral features and identify molecular N2 as the dominant dopant state. Rather than forming substitutional acceptors, implanted nitrogen evolves toward N2-like configurations stabilized in defect-rich environments associated with local β→γ-like structural motifs. This behavior reflects a thermally driven reconfiguration of nitrogen within the damaged layer. These results demonstrate that dopant incorporation can proceed via molecularization pathways that bypass conventional substitutional doping, providing a general mechanism for dopant deactivation under nonequilibrium incorporation conditions in oxides.

Afiliacje autorów:
Demchenko I. N. - Institute of Physics, Polish Academy of Sciences (PL)
Shokri A. - inna afiliacja
Syryanyy Y. - Institute of Physics, Polish Academy of Sciences (PL)
Melikhov Y. - IPPT PAN
Chernyshova M. - Institute of Plasma Physics and Laser Microfusion (PL)
Turek M. - inna afiliacja
Droździel A. - inna afiliacja
Munnik F. - inna afiliacja
Jakieła R. - inna afiliacja
Minikayev R. - inna afiliacja
Domagala J. Z. - inna afiliacja
Derkachova A. - inna afiliacja
Zaja̧c M. - inna afiliacja
Krajczewski J. - inna afiliacja
Grzanka E. - inna afiliacja
Galazka Z. - inna afiliacja
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