Browsing by Author "Mayer, István"
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One- and two-center energy components in the atoms in molecules theory

Energy partitioning for "fuzzy" atoms

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Second-order Møller-Plesset perturbation theory without basis set superposition error: II: open-shell systems

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One- and two-center physical space partitioning of the energy in the density functional theory

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Effective atomic orbitals for fuzzy atoms

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Local spins: improved Hilbert-space analysis

Toward a Unique Definition of the Local Spin

Nine Question on Energy Decomposition Analysis