Convergence from clusters to the bulk solid: Ab initio calculations of (MgO)X X =2-16 clusters

International Journal of Quantum Chemistry

Volumn 73, Issue 4, 1999, Pages 377-386

  Lü, Xin ^a   Xu, Xin ^a   Wang, Nanqin ^a   Zhang, Qianer ^a  

^a XIAMEN UNIVERSITY   (China)

Author keywords

Ab initio calculations; Cluster modeling; Cluster surface analogy; Magnesium oxide; Oxygen adsorption

Indexed keywords

EID: 0003681390     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-461X(1999)73:4<377::AID-QUA7>3.0.CO;2-D     Document Type: Article

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