A ‘universal' B3LYP-based method for gas-phase molecular properties: bond dissociation enthalpy, ionization potential, electron and proton affinity and gas-phase acidity

Author: Wright J.S.   Rowley C.N.   Chepelev L.L.  

Publisher: Taylor & Francis Ltd

ISSN: 1362-3028

Source: Molecular Physics, Vol.103, Iss.6-8, 2005-03, pp. : 815-823

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Abstract