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Electron Binding Energies of Free Base Porphyrin and Magnesium-Porphyrin: A Sequential Born-Oppenheimer Molecular Dynamics/Quantum Mechanics Approach

AuthID
P-003-7CP

Author(s)

Martiniano, HFMC

Costa Cabral, BJC

Tipo de Documento

Article

Year published

2010

Publicado

in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, ISSN: 0166-1280

Volume: 946, Número: 1-3, Páginas: 26-32 (7)

Conference

9Th National Meeting of Physical Chemistry, Date: JUN 15-16, 2009, Location: Aveiro, PORTUGAL, Patrocinadores: Portuguese Chem Soc, Div Phys Chem, Host: Univ Aveiro

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Publication Identifiers

DOI: 10.1016/j.theochem.2009.09.023

SCOPUS: 2-s2.0-77649184040

Wos: WOS:000276625400006

Source Identifiers

ISSN: 0166-1280

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Electron Binding Energies of Free Base Porphyrin and Magnesium-Porphyrin: A Sequential Born-Oppenheimer Molecular Dynamics/Quantum Mechanics Approach

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Electron Binding Energies of Free Base Porphyrin and Magnesium-Porphyrin: A Sequential Born-Oppenheimer Molecular Dynamics/Quantum Mechanics Approach

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