Abstract
A full understanding of the physics of metallic bonding, including the energy, structure, and dynamics of perfect crystals, of defects such as substitutional impurities, vacancies, etc., of liquids and liquid mixtures, and finally of metastable phases such as glasses, requires the solution of the Schrödinger equation for 1023 electrons, all interacting with one another and with the positive ions. For a perfect crystal, Bloch’s theorem allows us to solve the equation only in one unit cell, and the electron—electron interaction problem may be greatly simplified by introducing the local-density approximation assuming that the exchange correlation potential is determined by the local electron density.
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Hafner, J. (1985). Pair Potentials in Metals and Alloys: Order, Stability, and Dynamics. In: March, N.H., Street, R.A., Tosi, M.P. (eds) Amorphous Solids and the Liquid State. Physics of Solids and Liquids. Springer, Boston, MA. https://doi.org/10.1007/978-1-4757-9156-3_4
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DOI: https://doi.org/10.1007/978-1-4757-9156-3_4
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