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Effects of spin contamination on the stability and spin density of wave function of graphene: comparison between first principle and density functional methods
by
Lee, Sin Ang
,
Shukri Sulaiman
,
Mohamed Ismail Mohamed-Ibrahim
Published 2012
“… in the Hartree-Fock wavefunction (HF),
Møller
-
Plesset
perturbation
theory
(second order, MP2 and fourth order…”
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Universiti Kebangasaan Malaysia
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Lee, Sin Ang
1
Mohamed Ismail Mohamed-Ibrahim,
1
Shukri Sulaiman,
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English
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