Published April 15, 1970
| public
Journal Article
A new type of wavefunction for BH
Abstract
The wavefunctions of BH have been obtained using a generalization of the valence bond and Hartree-Fock methods known as the Spin-Coupling Optimized GI (SOGI) method. The shapes of the bonding and especially the nonbonding orbitals are discussed as are several properties of the molecules.
Additional Information
© 1970 Published by Elsevier B.V. Received 24 February 1970. Partially supported by grans (GP-6965 and GP-15423) from the National Science Foundation. Arthur Amos Noyes Laboratory of Chemical Physics Contribution No. 4009Additional details
- Eprint ID
- 88073
- Resolver ID
- CaltechAUTHORS:20180720-133817879
- GP-6965
- NSF
- GP-15423
- NSF
- NDEA Fellowship
- NSF Predoctoral Fellowship
- Alfred P. Sloan Foundation
- Created
-
2018-07-20Created from EPrint's datestamp field
- Updated
-
2021-11-16Created from EPrint's last_modified field
- Other Numbering System Name
- Arthur Amos Noyes Laboratory of Chemical Physics
- Other Numbering System Identifier
- 4009