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Structure: Internal structure identifier : 330437

Nine questions on energy decomposition analysis

Juan Andres , Paul Ayers , Roberto A Boto , Ramon Carbó‐dorca , Henry Chermette et al.
Journal of Computational Chemistry, 2019, 40 (26), pp.2248-2283. ⟨10.1002/jcc.26003⟩
Journal articles hal-02330538v1

Cu(bipy)2+/TEMPO-Catalyzed Oxidation of Alcohols: Radical or Nonradical Mechanism?

Paola Belanzoni , Carine Michel , Evert Jan Baerends
Inorganic Chemistry, 2011, 50 (23), pp.11896-11904. ⟨10.1021/ic200725k⟩
Journal articles hal-01112565v1

On the molecular optical nonlinearity of halogen-bond-forming azobenzenes

M. Virkki , A. Maurice , A. Forni , M. Sironi , V. Dichiarante et al.
Physical Chemistry Chemical Physics, 2018, 20 (45), pp.28810-28817. ⟨10.1039/c8cp05392h⟩
Journal articles hal-02289845v1