Band structure calculations on one-dimensional stacks of extended phthalocyanine-based macrocycles

Synthetic Metals

Volumn 42, Issue 3, 1991, Pages 2647-2652

  Orti, E ^a   Crespo, R ^a   Piqueras, M C ^a   Bredas, J L ^b  

^a UNIVERSITY OF VALENCIA   (Spain)

^b UNIVERSITY OF MONS   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS - ELECTRONIC PROPERTIES; BAND STRUCTURE - CALCULATIONS;

PHTHALOCYANINES; STACKING STRUCTURES; SYNTHETIC METALS;

ORGANOMETALLICS;

EID: 0026156220     PISSN: 03796779     EISSN: None     Source Type: Journal    
DOI: 10.1016/0379-6779(91)91444-F     Document Type: Article

References (23)

1. Porphyrinic Molecular Metals
2. Bisaxially Substituted 2,3-Naphthalocyaninatoiron Compounds
3. (1,2-Naphthalocyaninato)eisen(II)-Verbindungen mit Isocyaniden als axiale Liganden; Kristallstruktur eines Isomeren des Bis(cyclohexylisocyanid)-(1,2-naphthalocyaninato)eisen(II)
4. 9,10-Phenanthrenocyaninatoeisen(II) (PhcFe) und axial koordinierte Isocyanid-Komplexe
5. Influence of annelation on the electronic properties of phthalocyanine macrocycles
6. A new general methodology for deriving transferable atomic potentials in molecules
7. Valence effective Hamiltonian technique for nitrogen containing polymers: Electronic structure of polypyrrole, pyrolized polyacrylonitrile, paracyanogen, polymethineimine, and derivatives
8. Electronic structure of metal-free phthalocyanine: A valence effective Hamiltonian theoretical study
9. Theoretical investigation of three-dimensional phthalocyanine structures: comparison of the electronic properties of a model system for cyano-(phthalocyaninato)cobalt(III) with metal-free β-phthalocyanine
10. Electronic structure of phthalocyanines: Theoretical investigation of the optical properties of phthalocyanine monomers, dimers, and crystals
11. The location of the inner hydrogen atoms of phthalocyanine: a neutron diffraction study
12. Bridged macrocyclic transition metal complexes as semiconducting materials