Visualitzant Articles publicats (D-Q) per matèria "Funcions d'ona"

Electron localization function at the correlated level

Effective atomic orbitals for fuzzy atoms

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Local spins: improved Hilbert-space analysis

Benchmark Study on the Smallest Bimolecular Nucleophilic Substitution Reaction: H-+CH4 -> CH4+H-

Bonding quandary in the [Cu3S2]3+ core: Insights from the analysis of domain averaged fermi holes and the local spin

The Atomic orbitals of the topological atom

Local spin analysis and chemical bonding

New approximation to the third-order density: application to the calculation of correlated multicenter indices

Quantification of the donor-acceptor character of ligands by the effective fragment orbitals

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