The relativistic Scott correction for atoms and molecules

Comm. Pure Appl. Math. 63 (2010), no. 1, 39--118 We prove the first correction to the leading Thomas-Fermi energy for the ground state energy of atoms and molecules in a model where the kinetic energy of the electrons is treated relativistically. The leading Thomas-Fermi energy, established in [Sore...

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Hauptverfasser: Solovej, Jan Philip, Sørensen, Thomas Østergaard, Spitzer, Wolfgang L
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Sprache:eng
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Zusammenfassung:Comm. Pure Appl. Math. 63 (2010), no. 1, 39--118 We prove the first correction to the leading Thomas-Fermi energy for the ground state energy of atoms and molecules in a model where the kinetic energy of the electrons is treated relativistically. The leading Thomas-Fermi energy, established in [Sorensen], as well as the correction given here are of semi-classical nature. Our result on atoms and molecules is proved from a general semi-classical estimate for relativistic operators with potentials with Coulomb-like singularities. This semi-classical estimate is obtained using the coherent state calculus introduced in [Solovej-Spitzer]. The paper contains a unified treatment of the relativistic as well as the non-relativistic case.
DOI:10.48550/arxiv.0808.2163