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First-principles local density approximation (generalized gradient approximation) +U study of catalytic Ce[sub n]O[sub m] clusters: U value differs from bulk
Li, S. F., Lu, Heqiang, Li, Pinglin, Yang, Zongxian, Guo, Z. X.Volume:
128
Year:
2008
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.2907857
File:
PDF, 1.13 MB
english, 2008