Understanding X‑ray Spectroscopy of Carbonaceous Materials by Combining Experiments, Density Functional Theory, and Machine Learning. Part I: Fingerprint Spectra

Carbonaceous materials, especially tetrahedral amorphous carbon (ta-C), can form complex functionalized surface structures and are thus promising candidates for applications in biomedical devices and electrochemistry. Functional groups at ta-C surfaces have been widely studied by spectroscopic techn...

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Veröffentlicht in:	Chemistry of materials 2019-11, Vol.31 (22), p.9243-9255
Hauptverfasser:	Aarva, Anja, Deringer, Volker L, Sainio, Sami, Laurila, Tomi, Caro, Miguel A
Format:	Artikel
Sprache:	eng
Schlagworte:	INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
Online-Zugang:	Volltext
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