Periodic Hartree-Fock study of B1 ⇌ B2 reactions: phase transition in CaO
Author:
Publisher
Elsevier BV
Subject
Space and Planetary Science,Physics and Astronomy (miscellaneous),Geophysics,Astronomy and Astrophysics
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4. The phase transition in alkaline-earth oxides: a comparison ofab initioHartree-Fock and density functional calculations;Journal of Physics: Condensed Matter;1998-08-10
5. Thermodynamics and mechanism of theB1-B2phase transition in group-I halides and group-II oxides;Physical Review B;1998-05-01
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