화학공학소재연구정보센터
검색결과 : 8건
No. Article
1 Photo-CIDNP Reveals Different Protonation Sites Depending on the Primary Step of the Photoinduced Electron-/Proton-Transfer Process with Ru(II) Polyazaaromatic Complexes
Troian-Gautier L, Mugeniwabagara E, Fusaro L, Cauet E, Kirsch-De Mesmaeker A, Luhmer M
Journal of the American Chemical Society, 139(42), 14909, 2017
2 Electron-Attachment-Induced DNA Damage: Instantaneous Strand Breaks
Cauet E, Bogatko S, Lievin J, De Proft F, Geerlings P
Journal of Physical Chemistry B, 117(33), 9669, 2013
3 A theoretical spectroscopy investigation of oxosumanenes
Cauet E, Jacquemin D
Chemical Physics Letters, 519-20, 49, 2012
4 Ion Association in AlCl3 Aqueous Solutions from Constrained First-Principles Molecular Dynamics
Cauet E, Bogatko SA, Bylaska EJ, Weare JH
Inorganic Chemistry, 51(20), 10856, 2012
5 Density Functional Theory Interpretation of the H-1 Photo-Chemically Induced Dynamic Nuclear Polarization Enhancements Characterizing Photoreduced Polyazaaromatic Ru(II) Coordination Complexes
Cauet E, Bogatko S, Mugeniwabagara E, Fusaro L, Mesmaeker AKD, Luhmer M, Vaeck N
Inorganic Chemistry, 49(17), 7826, 2010
6 Vertical Ionization Potentials of Nucleobases in a Fully Solvated DNA Environment
Cauet E, Valiev M, Weare JH
Journal of Physical Chemistry B, 114(17), 5886, 2010
7 Ab Initio Study of the Electron Transfer in an Ionized Stacked Complex of Guanines
Cauet E, Lievin J
Journal of Physical Chemistry A, 113(36), 9881, 2009
8 Ab initio study of the ionization of the DNA bases: Ionization potentials and excited states of the cations
Cauet E, Dehareng D, Lievin J
Journal of Physical Chemistry A, 110(29), 9200, 2006