2008•Theoretical Chemistry AccountsRequires access

On the basis set superposition error in supermolecular calculations of interaction-induced electric properties: many-body components

Bartłomiej Skwara, Wojciech Bartkowiak, Daniel L. Silva

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Key concepts: Counterpoise, Interaction energy, Basis set, Superposition principle, Basis (linear algebra), Function (biology), Computational chemistry, Basis function

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On the basis set superposition error in supermolecular calculations of interaction-induced electric properties: many-body components — Research Paper | ScholarLens