Palavra-chave: MOLECULAR MECHANICS

RUTHENIUM IRON CARBON NANOTUBES SEMIEMPIRICAL CRYSTAL STRUCTURE PYRROLIZIDINE ALKALOIDS DFT ZINDO HETEROCYCLIC N-DONOR LIGAND COPPER PM3 TRINUCLEAR CLUSTER ELECTRONIC STRUCTURE ELECTROCHEMICAL SENSOR AB INITIO SUPRAMOLECULAR ASSEMBLY SEMIEMPIRICAL CALCULATION PLATINUM ELECTROCATALYTIC OXIDATION PORPHYRIN