Santos, Carlos da Silva dos [UNESP]Drigo Filho, Elso [UNESP]Ricotta, Regina Maria [UNESP]2015-10-212015-10-212015-06-15International Journal Of Quantum Chemistry, v. 115, n. 12, p. 765-770, 2015.0020-7608http://hdl.handle.net/11449/128843In this work, the quantum confinement effect is proposed as the cause of the displacement of the vibrational spectrum of molecular groups that involve hydrogen bonds. In this approach, the hydrogen bond imposes a space barrier to hydrogen and constrains its oscillatory motion. We studied the vibrational transitions through the Morse potential, for the NH and OH molecular groups inside macromolecules in situation of confinement (when hydrogen bonding is formed) and nonconfinement (when there is no hydrogen bonding). The energies were obtained through the variational method with the trial wave functions obtained from supersymmetric quantum mechanics formalism. The results indicate that it is possible to distinguish the emission peaks related to the existence of the hydrogen bonds. These analytical results were satisfactorily compared with experimental results obtained from infrared spectroscopy. (c) 2015 Wiley Periodicals, Inc.765-770engquantum confinementhydrogen bondsupersymmetric quantum mechanicsvariational methodNH and OH molecular groupsArtigo10.1002/qua.24894WOS:000354238700003Acesso restrito3277957413291567