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Published in 2022 at "Materials"
DOI: 10.3390/ma15238492
Abstract: The fluorine-adsorption-induced local bond relaxation and valence-energy-state evolution of the Ti(0001) surface were examined through density functional theory calculations. The predicted bond–band–barrier (3 B) correlation notation framework for the interaction of the fluorine adsorbate with…
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Keywords:
structure;
modulated electronic;
surface;
electronic structure ... See more keywords