𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Ab initio calculation of excitonic effects in realistic materials

✍ Scribed by Stefan Albrecht; Giovanni Onida; Lucia Reining; Rodolfo Del Sole


Book ID
117627249
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
445 KB
Volume
10
Category
Article
ISSN
0927-0256

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Ab initio calculation of ligand field co
✍ Betty Ng; D.J. Newman πŸ“‚ Article πŸ“… 1986 πŸ› Elsevier Science 🌐 English βš– 227 KB

Many-body perturbation theory with non-orthogonal basis states has been used to determine contributions to &and field correlation effects in the system Mn 2+-F-(with Mn-F distance the same as in MnF,). A new phenomenological parameterization is proposed.

Ab initio calculation of polyethylene de
✍ Suhai, S. πŸ“‚ Article πŸ“… 1983 πŸ› Wiley (John Wiley & Sons) 🌐 English βš– 403 KB

## Abstract The longitudinal acoustic elastic modulus of polyethylene has been calculated with the aid of the __ab initio__ crystal orbital method applying corrections also for electronic correlation effects. The basis set and correlation dependence of the elastic modulus have been investigated. Th