TY - JOUR AU - Beltrán Fínez, Juan Ignacio AU - Gallego, Silvia AU - Cerdá, Jorge AU - Moya, Serafín AU - Muñoz, Carmen PY - 2004 DO - 10.1021/jp047051t SN - 1520-6106 UR - https://hdl.handle.net/20.500.14352/91883 T2 - Journal of Physical Chemistry B AB - The mechanisms that control at the quantum level the adhesion of metals to ZrO2 are studied on the basis of density functional theory calculations of the Ni/c-ZrO2 interface. Our results indicate that the interface fragility is inherently connected to... LA - eng M2 - 15439 PB - American Chemical Society (ACS) KW - Ceramics KW - Defects in solids KW - Interfaces KW - Interfacial structure KW - Surface interactions TI - Internal Ceramic Reconstruction Weakens Metal−ZrO_2 adhesion TY - journal article VL - 108 ER -