Atomic Radii for Depicting Atoms in a Molecule

The effective atomic radius imaging the atoms in an equilibrium molecular structure is discussed for He, Ne, Ar, Kr, and Xe, based on the electrostatic field calculated with the Hartree-Fock and configuration interaction singles and doubles methods, both with and without the Douglas-Kroll-Hess relat...

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Veröffentlicht in:	Bulletin of the Chemical Society of Japan 2010-07, Vol.83 (7), p.782
Hauptverfasser:	Naka, Takatoshi, Hatano, Yasuyo, Yamamoto, Shigeyoshi, Noro, Takeshi, Tatewaki, Hiroshi
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
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