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• W2065632247 startingPage "3395" @default.
• W2065632247 abstract "A molecular-dynamics study on equiatomic NaPb, KPb, RbPb, and CsPb liquid alloys has been carried out to supplement earlier neutron-diffraction measurements. The alkali-metal atoms are assumed to be monovalent, positively charged ions while the Pb atoms are arranged in regular tetrahedra, (${mathrm{Pb}}_{4}$${)}^{4mathrm{ensuremath{-}}}$, so-called Zintl ions. A simplified version of the Tosi-Fumi potential has been used to represent the interatomic forces, except for the Pb-Pb interactions within a (${mathrm{Pb}}_{4}$${)}^{4mathrm{ensuremath{-}}}$ ion, which are approximated by a harmonic potential. The structure factors calculated from this molecular-ionic model prove to be in excellent agreement with the measured ones." @default.
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• W2065632247 date "1990-08-15" @default.
• W2065632247 modified "2023-10-04" @default.
• W2065632247 title "Molecular-dynamics study of liquid NaPb, KPb, RbPb, and CsPb alloys" @default.
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• W2065632247 doi "https://doi.org/10.1103/physrevb.42.3395" @default.
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