Effects of π -stacking interactions on the near carbon K -edge x-ray absorption fine structure: A theoretical study of the ethylene pentamer and the phthalocyanine dimer

Journal of Chemical Physics

Volumn 130, Issue 10, 2009, Pages

  Linares, Mathieu ^a   Stafström, Sven ^a   Norman, Patrick ^a  

^a LINKÖPING UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION; ETHYLENE; SPECTRUM ANALYSIS; X RAY ABSORPTION;

CARBON K EDGES; COMPLEX POLARIZATION PROPAGATORS; DENSITY FUNCTIONAL; ETHYLENE DIMERS; EXCHANGE-CORRELATION FUNCTIONAL; FREE BASE; ISOLATED MOLECULES; PENTAMER; PHTHALOCYANINE DIMERS; RYDBERG; SPECTRAL CHANGES; STACKED SYSTEMS; STACKING INTERACTIONS; TETRAMER; THEORETICAL STUDIES; TRANSITION ENERGIES; X-RAY ABSORPTION FINE STRUCTURES; X-RAY ABSORPTION SPECTRUM;

DENSITY FUNCTIONAL THEORY;

EID: 62549084282     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3079820     Document Type: Article

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