[1] Tech Univ Dresden, Theoret Chem, D-01062 Dresden, Germany
[2] Univ Sao Paulo, Inst Chem, BR-05508000 Sao Paulo, Brazil
[3] Northeast Ctr Strateg Technol, Lab Microscope & Microanal, BR-50740540 Recife, Brazil
[4] Univ Fed Maranhao, Ctr Ciencias Exatas & Tecnol, Dept Quim, BR-65080805 Sao Luis, Brazil
[5] Pontificia Univ Catolica Rio de Janeiro, Dept Engn Quim & Mat, BR-22451900 Rio de Janeiro, Brazil