First-principles study of phase stability, electronic and mechanical properties of plutonium sub-oxides
2019 ◽
Vol 21
(30)
◽
pp. 16818-16829
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Keyword(s):
Formation energies of PuO2, α-Pu2O3 and sub-oxides PuO2−x (0.0 < x < 0.5) are determined using density functional theory employing generalised gradient approximation corrected with an effective Hubbard parameter.
2014 ◽
Vol 16
(27)
◽
pp. 14096-14107
◽
2017 ◽
Vol 19
(31)
◽
pp. 20677-20683
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