Hydrogenated derivatives of hexacoordinated metallic Cu

Autor: E, Unsal, F, Iyikanat, H, Sahin, R T, Senger
Rok vydání: 2018
Zdroj: RSC advances. 8(70)
ISSN: 2046-2069
Popis: Herein, we carried out first-principles calculations based on density functional theory to investigate the effects of surface functionalization with hydrogen atoms on structural, dynamical and electronic properties of Cu
Databáze: OpenAIRE