Dissociation and multiple ionization energies for five polycyclic aromatic hydrocarbon molecules

Journal of Chemical Physics

Volumn 134, Issue 4, 2011, Pages

  Holm, A I S ^a   Johansson, H A B ^a   Cederquist, H ^a   Zettergren, H ^a  

^a STOCKHOLM UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

BIPHENYLENE; CHARGE STATE; CORONENE; CROSS SECTION; DENSITY FUNCTIONAL THEORY CALCULATIONS; DIFFERENT SIZES; DISSOCIATION ENERGIES; IONIZATION ENERGIES; LINEAR DEPENDENCY; MULTIPLE IONIZATION; REACTION BARRIERS; THERMODYNAMICALLY STABLE; TIME-SCALES; VERTICAL IONIZATION ENERGY;

ANTHRACENE; DENSITY FUNCTIONAL THEORY; DISSOCIATION; IONIZATION POTENTIAL; MOLECULES; NAPHTHALENE; ORGANIC COMPOUNDS; QUANTUM CHEMISTRY;

AROMATIC HYDROCARBONS;

ANTHRACENE; ANTHRACENE DERIVATIVE; BIPHENYL DERIVATIVE; CARBON; CORONENE; HYDROGEN; ION; NAPHTHALENE; NAPHTHALENE DERIVATIVE; POLYCYCLIC AROMATIC HYDROCARBON; POLYCYCLIC HYDROCARBON; PYRENE; PYRENE DERIVATIVE;

ARTICLE; CHEMISTRY; QUANTUM THEORY; THERMODYNAMICS;

ANTHRACENES; BIPHENYL COMPOUNDS; CARBON; HYDROGEN; IONS; NAPHTHALENES; POLYCYCLIC COMPOUNDS; POLYCYCLIC HYDROCARBONS, AROMATIC; PYRENES; QUANTUM THEORY; THERMODYNAMICS;

EID: 79551599151     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3541252     Document Type: Article

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