Optical to ultraviolet spectra of sandwiches of benzene and transition metal atoms: Time dependent density functional theory and many-body calculations

Journal of Chemical Physics

Volumn 132, Issue 4, 2010, Pages

  Martinez J I ^a,b,c   Garcia Lastra J M ^c,d,e   Lopez M J ^a   Alonso, J A ^a,d,f  

^a UNIVERSITY OF VALLADOLID   (Spain)

^b UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^c TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

^d UNIVERSITY OF THE BASQUE COUNTRY UPV EHU   (Spain)

^e European Theoretical Spectroscopy Facility (ETSF)   (Spain)

^f DONOSTIA INTERNATIONAL PHYSICS CENTER DIPC   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE MOLECULES; CLUSTER SIZES; EXPERIMENTAL STUDIES; INFINITE CHAINS; MANY BODY PERTURBATION THEORY; MANY-BODY CALCULATIONS; METAL ATOMS; METALLIZATIONS; NUMBER OF LAYERS; OPTICAL SPECTRA; RELATIVE ABUNDANCE; SALIENT FEATURES; SANDWICH CLUSTERS; TIME DEPENDENT DENSITY FUNCTIONAL THEORY; TRANSITION METAL ATOMS;

ATOMIC SPECTROSCOPY; ATOMS; BENZENE; CHROMIUM; DYES; EXCITATION ENERGY; ISOMERS; OPTICAL PROPERTIES; PERTURBATION TECHNIQUES; SPECTROSCOPIC ANALYSIS; TITANIUM; ULTRAVIOLET SPECTROSCOPY; VANADIUM COMPOUNDS;

DENSITY FUNCTIONAL THEORY;

BENZENE; TRANSITION ELEMENT;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; PHOTOCHEMISTRY; QUANTUM THEORY; TIME; ULTRAVIOLET RADIATION;

BENZENE; MODELS, CHEMICAL; PHOTOCHEMISTRY; QUANTUM THEORY; TIME FACTORS; TRANSITION ELEMENTS; ULTRAVIOLET RAYS;

EID: 75749112577     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3300129     Document Type: Article

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