TY - JOUR TI - Quantum chemical DFT study of the interaction between molecular oxygen and FeN4 complexes, and effect of the macrocyclic ligand PY - 2014 AU - Silva, Adilson Luís Pereira AU - Almeida, Luciano Farias de AU - Marques, Aldalea Lopes Brandes AU - Costa, Hawbertt Rocha AU - Tanaka, Auro Atsushi AU - Silva, Alberico Borges Ferreira da AU - Varela Junior, Jaldyr de Jesus Gomes T2 - Journal of Molecular Modeling SN - 1610-2940 DO - 10.1007/s00894-014-2131-x UR - https://doi.org/10.1007/s00894-014-2131-x PP - New York VL - 20 IS - 3 SP - 2131 ER -