TY - JOUR
T1 - Electronic and structural features of Pd3 cluster on MgO(100) surface cluster
AU - Yamauchi, Ryo
AU - Gunji, Isao
AU - Endou, Akira
AU - Yin, Xilin
AU - Kubo, Momoji
AU - Chatterjee, Abhijit
AU - Miyamoto, Akira
PY - 1998
Y1 - 1998
N2 - The structural characters and the electronic features of Pd3 cluster on the MgO(100) surface cluster were investigated by performing density functional calculations. The geometric features of the cluster shape of the Pd3 cluster depended on the kinds of neighboring atoms interacting with the Pd atoms. The metal-support interatomic distance was compared with experimental results and the quantitative consistency was found. The dissociation of the Pd3 cluster occurred, indicating the way of the bond breaking of metal cluster.
AB - The structural characters and the electronic features of Pd3 cluster on the MgO(100) surface cluster were investigated by performing density functional calculations. The geometric features of the cluster shape of the Pd3 cluster depended on the kinds of neighboring atoms interacting with the Pd atoms. The metal-support interatomic distance was compared with experimental results and the quantitative consistency was found. The dissociation of the Pd3 cluster occurred, indicating the way of the bond breaking of metal cluster.
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U2 - 10.1016/S0169-4332(98)00117-2
DO - 10.1016/S0169-4332(98)00117-2
M3 - Conference article
AN - SCOPUS:17144454947
SN - 0169-4332
VL - 130-132
SP - 572
EP - 575
JO - Applied Surface Science
JF - Applied Surface Science
T2 - Proceedings of the 1997 4th International Symposium on Atomically Controlled Surfaces and Intefaces, ACSI-4
Y2 - 27 October 1997 through 30 October 1997
ER -