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A consistent set of trial functions for conical shells

✍ Scribed by M. El-Raheb; P. Wagner

Publisher
Elsevier Science
Year
1980
Tongue
English
Weight
639 KB
Volume
73
Category
Article
ISSN
0022-460X

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πŸ“œ SIMILAR VOLUMES

Compatibility of correlation-consistent
Compatibility of correlation-consistent basis sets with a hybrid Hartree-Fock/density functional method
✍ Raymond, Kevin S.; Wheeler, Ralph A. πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 155 KB πŸ‘ 2 views

The present study examines the feasibility of combining the correlation-consistent basis sets developed by Dunning and coworkers with the hybrid Hartree᎐Fockrdensity functional method B3LYP. Furthermore, Ž . extrapolation to the complete basis set CBS limit minimizes errors due to the presence of an