Br2(X) microsolvation in helium clusters: Effect of the interaction on the quantum solvent density distribution

ChemPhysChem

Volumn 6, Issue 7, 2005, Pages 1348-1356

  Di Paola, Cono ^a   Gianturco, Franco A ^a   López Durán, David ^b   De Lara Castells, Maria Pilar ^b   Delgado Barrio, Gerardo ^b   Villarreal, Pablo ^b   Jellinek, Julius ^c  

^a SAPIENZA UNIVERSITY OF ROME   (Italy)

^b INSTITUTO DE MATEMÁTICAS Y FÍSICA FUNDAMENTAL   (Spain)

^c ARGONNE NATIONAL LABORATORY   (United States)

Author keywords

Ab initio calculations; Bromine; Cluster compounds; Helium; Microsolvation

Indexed keywords

BOSONS; BROMINE; CALCULATIONS; GROUND STATE; HELIUM; MOLECULES; POTENTIAL ENERGY; QUANTUM CHEMISTRY; SOLVENTS; WAVE FUNCTIONS;

AB INITIO CALCULATIONS; BORN-OPPENHEIMER POTENTIAL ENERGY SURFACES; CLUSTER COMPOUNDS; DENSITY DISTRIBUTIONS; GROUND-STATE ENERGIES; MICROSOLVATION; QUANTUM WAVE FUNCTIONS; SOLVENT STRUCTURES;

BROMINE COMPOUNDS;

EID: 22444447999     PISSN: 14394235     EISSN: None     Source Type: Journal    
DOI: 10.1002/cphc.200400530     Document Type: Article

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