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The Journal of Physical Chemistry. A|September 13, 2016
Probing Molecular Interactions in Functionalized Asymmetric Quaternary Ammonium-Based Dicationic Ionic LiquidsPrakash L Verma, Libero J Bartolotti, Shridhar P GejjiThe Journal of Physical Chemistry. A|November 10, 2006
Estimation of intramolecular hydrogen bond energy via molecular tailoring approachMilind M Deshmukh, Shridhar R Gadre, Libero J BartolottiPhysical Chemistry Chemical Physics : PCCP|September 25, 2013
A computational study of acid catalyzed aerosol reactions of atmospherically relevant epoxidesIvan R Piletic, Edward O Edney, Libero J BartolottiThe Journal of Chemical Physics|June 16, 2006
Effect of additional hydrogen peroxide to H2O2...(H2O)n, n=1 and 2 complexes: quantum chemical studyAnant D Kulkarni, Rajeev K Pathak, Libero J BartolottiThe Journal of Physical Chemistry. A|October 5, 2017
Barrierless Reactions with Loose Transition States Govern the Yields and Lifetimes of Organic Nitrates Derived from IsopreneIvan R Piletic, Edward O Edney, Libero J BartolottiJournal of Computational Chemistry|July 28, 2011
Intramolecular hydrogen bond energy and cooperative interactions in α-, β-, and γ-cyclodextrin conformersMilind M Deshmukh, Libero J Bartolotti, Shridhar R GadrePhysical Chemistry Chemical Physics : PCCP|October 31, 2017
Noncovalent interactions underlying binary mixtures of amino acid based ionic liquids: insights from theorySoniya S Rao, Libero J Bartolotti, Shridhar P GejjiThe Journal of Chemical Physics|August 17, 2018
Harmonizing accuracy and efficiency: A pragmatic approach to fragmentation of large moleculesSubodh S Khire, Libero J Bartolotti, Shridhar R GadreThe Journal of Chemical Physics|August 14, 2009
Microsolvation of methyl hydrogen peroxide: ab initio quantum chemical approachAnant D Kulkarni, Dhurba Rai, Libero J Bartolotti, et al.The Journal of Physical Chemistry. A|October 20, 2006
Interaction of peroxyformic acid with water molecules: a first-principles studyAnant D Kulkarni, Dhurba Rai, Libero J Bartolotti, et al.Pageof 3