Remarkable enhancement of adsorption stability for H2O and CO2 molecules on ceramic BaTiO3 nanocluster surfaces: Theoretical study

The adsorption stability for H2O, CO2 and related molecules on surfaces of ceramic BaTiO3 solids and BaTiO3 nanoclusters was investigated by first-principles theoretical calculations. I found remarkable enhancement of stability for their adsorption on BaTiO3 nanocluster surfaces compared with that o...

Ausführliche Beschreibung

Bibliographische Detailangaben

1. Verfasser:	Higai Shin'ichi
Format:	Tagungsbericht
Sprache:	eng
Schlagworte:	Adsorption Barium titanates Carbon dioxide Dependence First principles Nanoclusters Solid surfaces Surface chemistry Surface stability
Online-Zugang:	Volltext
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