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Second-order energy components in basis-set-superposition-error-free intermolecular perturbation theory

✍ Scribed by A. Hamza; Á. Vibók; G. J. Halász; I. Mayer


Book ID
105885429
Publisher
Springer
Year
2001
Tongue
English
Weight
237 KB
Volume
107
Category
Article
ISSN
1432-2234

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Comparison of basis set superposition er
✍ G. J. Halász; Á. Vibók; I. Mayer 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 281 KB 👁 2 views

Recently, two different but conceptually similar basis set Ž . superposition error BSSE free second-order perturbation theoretical schemes were developed by us that are being based on the chemical Hamiltonian Ž . approach CHA . Using these CHA-MP2 and CHA-PT2 methods, a comparison is made between th