Nota de FísicaPublicado
First-Principles Calculations of Mössbauer Hyperfine Parameters for Solids and Large Molecules
D. Guenzburger; D.E. Ellis; Z. Zeng
1997
Datos de la publicación
- Autores
- D. Guenzburger; D.E. Ellis; Z. Zeng
- Tipo
- Nota de Física
- Estado
- Publicado
- Fecha de publicación
- 1997
- Descripción
- Electronic structure calculations based on Density Functional theory were performed for solids and large molecules . The solids were represented by clusters of 60-100 atoms embedded in the potential of the external crystal. Magnetic moments and Mössbauer hyperfine parameters were derived.
- Año
- 1997
- Número
- CBPF-NF-065/97
- Vínculo con tesis
- No
- Vínculo con beca
- No