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The Journal of Chemical Physics|October 24, 2014
Communication: Localized molecular orbital analysis of the effect of electron correlation on the anomalous isotope effect in the NMR spin-spin coupling constant in methaneM Natalia C Zarycz, Stephan P A Sauer, Patricio F ProvasiThe Journal of Physical Chemistry. B|July 21, 2006
Theoretical study of HCN and HNC neutral and charged clustersMarina Sanchez, Patricio F Provasi, Gustavo A Aucar, et al.Journal of Molecular Modeling|September 23, 2025
A nuclear chemical descriptor based on NMR databases for molecular information: characterization of π-conjugated oligomersJoão P C Oliveira, Murillo H Queiroz, Patricio F Provasi, et al.Journal of Computational Chemistry|July 8, 2021
Physical achirality in geometrically chiral rotamers of hydrazine and boranylborane moleculesGabriel I Pagola, Marta B Ferraro, Patricio F Provasi, et al.The Journal of Chemical Physics|September 22, 2011
Electric field effects on nuclear magnetic shielding of the 1:1 and 2:1 (homo and heterochiral) complexes of XOOX' (X, X' = H, CH3) with lithium cation and their chiral discriminationIbon Alkorta, José Elguero, Patricio F Provasi, et al.Magnetic Resonance in Chemistry : MRC|November 11, 2008
Stereochemical dependence of NMR geminal spin-spin coupling constantsRubén H Contreras, Patricio F Provasi, Francisco P dos Santos, et al.Journal of Computational Chemistry|October 3, 2019
Noniterative Doubles Corrections to the Random Phase and Higher Random Phase Approximations: Singlet and Triplet Excitation EnergiesPi A B Haase, Rasmus Faber, Patricio F Provasi, et al.The Journal of Physical Chemistry. A|September 15, 2009
NMR chemical shielding and spin-spin coupling constants of liquid NH3: a systematic investigation using the sequential QM/MM methodRodrigo M Gester, Herbert C Georg, Sylvio Canuto, et al.Journal of Computational Chemistry|March 25, 2016
Computational study of basis set and electron correlation effects on anapole magnetizabilities of chiral moleculesNatalia Zarycz, Patricio F Provasi, Gabriel I Pagola, et al.The Journal of Physical Chemistry. A|July 22, 2014
Monte Carlo-quantum mechanics study of magnetic properties of hydrogen peroxide in liquid waterMaría Cristina Caputo, Patricio F Provasi, Lucía Benitez, et al.Pageof 4