𝔖 Bobbio Scriptorium
✦   LIBER   ✦

ChemInform Abstract: Ab initio Study of the Magnetic Coupling in Na6Fe2S6.

✍ Scribed by M. MOEDL; A. POVILL; J. RUBIO; F. ILLAS

Publisher
John Wiley and Sons
Year
2010
Weight
27 KB
Volume
28
Category
Article
ISSN
0931-7597

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Ab initio molecular orbital and density
Ab initio molecular orbital and density functional study of the C6H6β‹…I2 complex in the ground and excited electronic states
✍ A. M. Mebel; H. L. Lin; S. H. Lin πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 236 KB πŸ‘ 2 views

The structure and energetics of the C H и I complex have been studied 6 6 2 1 1.55 eV difference between the vertical and adiabatic excitation energies of 4 AЈ and the dramatic geometry change in the CT state.