Structural, electronic, and optical properties of the diindenoperylene molecule from first-principles density-functional theory

Physical Review A - Atomic, Molecular, and Optical Physics

Volumn 74, Issue 4, 2006, Pages

  Ramaniah, Lavanya M ^a,b   Boero, Mauro ^b  

^a BHABHA ATOMIC RESEARCH CENTRE   (India)

^b UNIVERSITY OF TSUKUBA   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

FIRST-PRINCIPLES TECHNIQUES; PHOTOABSORPTION; SOLVENT EFFECTS; TRIPLET EXCITED STATE;

ABSORPTION; ELECTRIC PROPERTIES; MATHEMATICAL MODELS; MICROSTRUCTURE; MOLECULAR STRUCTURE; OPTICAL PROPERTIES; OPTIMIZATION; PROBABILITY DENSITY FUNCTION; SEMICONDUCTING ORGANIC COMPOUNDS; VIBRATIONS (MECHANICAL);

ORGANIC COMPOUNDS;

EID: 33749471587     PISSN: 10502947     EISSN: 10941622     Source Type: Journal    
DOI: 10.1103/PhysRevA.74.042505     Document Type: Article

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