Palavra-chave: MOLECULAR MECHANICS

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