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Ground-state potential surface of thiazyl fluoride (NSF) - an ab initio study

✍ Scribed by Seeger, Rolf.; Seeger, Ute.; Bartetzko, Richard.; Gleiter, Rolf.


Book ID
127044519
Publisher
American Chemical Society
Year
1982
Tongue
English
Weight
613 KB
Volume
21
Category
Article
ISSN
0020-1669

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Ab initio studies of the ground-state po
✍ Gregory M. Wright; Richard J. Simmonds; David E. Parry πŸ“‚ Article πŸ“… 1988 πŸ› John Wiley and Sons 🌐 English βš– 399 KB

A b initio calculations employing a standard double-zeta basis set augmented with various polarization functions have been used to investigate the lowest energy region of the ground-state potential energy surface of the formamide molecule. Hartree-Fock calculations with only d polarization functions