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The Journal of Physical Chemistry. A|April 18, 2018
The Nature of the Interactions in Triethanolammonium-Based Ionic Liquids. A Quantum Chemical StudyIrina V Fedorova, Lyubov P SafonovaJournal of Molecular Modeling|July 9, 2017
Ab initio study of hydrogen bonding in the H3PO2 dimer and H3PO2-DMF complexIrina V Fedorova, Lyubov P SafonovaThe Journal of Physical Chemistry. A|December 19, 2018
Ab Initio Investigation of the Interionic Interactions in Triethylammonium-Based Protic Ionic Liquids: The Role of Anions in the Formation of Ion Pair and Hydrogen Bonded StructureIrina V Fedorova, Lyubov P SafonovaThe Journal of Physical Chemistry. A|April 6, 2019
Quantum Chemical Modeling of the Structure and H Bonding in Triethanolammonium-Based Protic Ionic Liquids with Sulfonic AcidsIrina V Fedorova, Lyubov P SafonovaJournal of Molecular Modeling|July 5, 2023
Proton transfer between sulfonic acids and various propylamines by density functional theory calculationsIrina V Fedorova, Lyubov P SafonovaThe Journal of Physical Chemistry. A|April 4, 2020
Ion Pair Structures and Hydrogen Bonding in RNH4- Alkylammonium Ionic Liquids with Hydrogen Sulfate and Mesylate Anions by DFT ComputationsIrina V Fedorova, Lyubov P SafonovaThe Journal of Physical Chemistry. A|June 20, 2018
Influence of Cation Size on the Structural Features and Interactions in Tertiary Alkylammonium Trifluoroacetates: A Density Functional Theory InvestigationIrina V Fedorova, Lyubov P SafonovaPhysical Chemistry Chemical Physics : PCCP|June 10, 2010
Physico-chemical and structural characterization of the binary system phosphoric acid-N,N-dimethylformamideYuliya A Fadeeva, Lyubov P Safonova, Ingmar PerssonJournal of Molecular Modeling|January 25, 2015
Computer simulation study of the intermolecular structure of phosphoric acid-N,N-dimethylformamide mixturesIrina V Fedorova, Michael G Kiselev, Lyubov P SafonovaThe Journal of Physical Chemistry. A|October 3, 2017
Ab Initio Study of Structural Features and H-Bonding in Alkylammonium-Based Protic Ionic LiquidsIrina V Fedorova, Michael A Krestyaninov, Lyubov P SafonovaPageof 2