Lista de

Linear response
6
"Relativistic effects on nuclear magnetic shieldings of CHnX 4-n and CHXYZ (X, Y, Z = H, F, Cl, Br, I)" (2012) Melo, J.I.; Maldonado, A.F.; Aucar, G.A. Journal of Chemical Physics. 137(21)
"CLOPPA analysis of the molecular polarizability and the energy of strong intramolecular hydrogen bonds: Resonance assisted?" (2012) Giribet, C.G.; Ruiz De Azúa, M.C. Journal of Physical Chemistry A. 116(49):12175-12183
"Theoretical study of the nuclear spin-molecular rotation coupling for relativistic electrons and non-relativistic nuclei" (2012) Aucar, I.A.; Gómez, S.S.; De Azúa, M.C.R.; Giribet, C.G. Journal of Chemical Physics. 136(20)
"Nuclear magnetic resonance shielding constants and chemical shifts in linear 199Hg compounds: A comparison of three relativistic computational methods" (2011) Arcisauskaite, V.; Melo, J.I.; Hemmingsen, L.; Sauer, S.P.A. Journal of Chemical Physics. 135(4)