... 3s and 3p states and O 2s and 2p states in BaTiO3 : (a) anisotropic Coulomb repulsions between Ti 3s and 3px ( y) states and O x ( y) 2s and 2px ( y) states, and between Ti 3s and 3pz states and ... between Ti 3s and 3pz 396 Ferroelectrics - Characterization and Modeling Ferroelectrics states and O 2pz states not favourably cause Ti ion displacement Experimentally, on the other hand, Kuroiwa ... (67) and (68), α * and β j* are expressed as j um , j , 4Q12 , j , β j* = β j + s11, j + s12, j α j* = α j − 4Q12, j s11, j + s12, j (69) where α j , β j and γ j are the Landau...