|
|||||
|
|
Localized orbitals,electric field gradients and diamagnetic shielding in hydrogen bonded systems |
|
| Authors: | J. Koller D. Kocjan M. Žaucer A. A |
| Affiliation: | Chemical Institute Boris Kidri?, University of Ljubljana, Ljubljana, Yugoslavia |
| Abstract: | Ab-initio localized molecular orbitals are used to evaluate the diamagnetic shieldings and the electric field gradients in hydrogen bonded systems. |
| Keywords: | |
| 本文献已被 ScienceDirect 等数据库收录！ | |