Interatomic potentials for mixed oxide and advanced nuclear fuels
نویسندگان
چکیده
منابع مشابه
Interatomic potentials for mixed oxide and advanced nuclear fuels
We extend our recently developed interatomic potentials for UO2 to the fuel system (U,Pu,Np)O2. We do so by fitting against an extensive database of ab initio results as well as to experimental measurements. The applicability of these interactions to a variety of mixed environments beyond the fitting domain is also assessed. The employed formalism makes these potentials applicable across all in...
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ژورنال
عنوان ژورنال: Physical Review B
سال: 2011
ISSN: 1098-0121,1550-235X
DOI: 10.1103/physrevb.83.094104