INVESTIGADORES
PICKHOLZ Monica Andrea
congresos y reuniones científicas
Título:
The molecular rectifier
Autor/es:
M. PICKHOLZ; M.C. DOS SANTOS
Lugar:
Snowbird
Reunión:
Conferencia; International Conference of Synthetic Metals (ICSM); 1995
Institución organizadora:
ICSM
Resumen:
We present a series of electronic and conformational studies on the push-pull system Z-â-(1-methyl-4-quinolinium)-ã-cyano-4-styryldicyanomethanide, CH3-Q3CNQ based on semi-empirical calculations to assess solvent, external electric field and correlation effects. The ground state conformation obtained is not of zwitterionic type, and a different interpretation of the rectifying behavior of this system is presented.
