575 research outputs found

    Metallic bonding due to correlations: A quantum chemical ab-initio calculation of the cohesive energy of mercury

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    Solid mercury in the rhombohedral structure is unbound within the self-consistent field (Hartree-Fock) approximation. The metallic binding is entirely due to electronic correlations. We determine the cohesive energy of solid mercury within an ab-initio many-body expansion for the correlation part. Electronic correlations in the 5d5d shell contribute about half to the cohesive energy. Relativistic effects are found to be very important. Very good agreement with the experimental value is obtained.Comment: 4 pages, 1 figur

    Discrete behavior of Seshadri constants on surfaces

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    Working over C, we show that, apart possibly from a unique limit point, the possible values of multi-point Seshadri constant for general points on smooth projective surfaces form a discrete set. In addition to its theoretical interest, this result is of practical value, which we demonstrate by giving significantly improved explicit lower bounds for Seshadri constants on P^2 and new results about ample divisors on blow ups of P^2 at general points.Comment: 14 pages, to appear in J. Pure App. Algebr
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