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List of works by Ekaterina I Izgorodina

A Hybrid Anion for Ionic Liquid and Battery Electrolyte Applications: Half Triflamide, Half Carbonate

scientific article published on 21 February 2019

A Systematic Study of DFT Performance for Geometry Optimizations of Ionic Liquid Clusters

scientific article published on 14 September 2020

A supramolecular twist to the structures of bis(polyfluorophenyl)mercurials

scientific article published in 2011

Accurate ab initio prediction of propagation rate coefficients in free-radical polymerization: Acrylonitrile and vinyl chloride

Addition-Fragmentation Kinetics of Fluorodithioformates (F-RAFT) in Styrene, Vinyl Acetate, and Ethylene Polymerization: An Ab Initio Investigation

article

Aluminium Speciation in 1-Butyl-1-Methylpyrrolidinium Bis(trifluoromethylsulfonyl)amide/AlCl3Mixtures

scientific article published on 01 January 2009

Anisotropic Thermal and Guest-Induced Responses of an Ultramicroporous Framework with Rigid Linkers

scientific article published on 16 February 2018

Bulk properties of aqueous graphene oxide and reduced graphene oxide with surfactants and polymers: adsorption and stability

scientific article published in 2018

Comprehensive Vibrational Spectroscopic Investigation of trans,trans,trans-[Pt(N3)2(OH)2(py)2], a Pt(IV) Diazido Anticancer Prodrug Candidate

scientific article published on 3 June 2016

Computational Studies of RAFT Polymerization–Mechanistic Insights and Practical Applications

Diamino protic ionic liquids for CO2 capture.

scientific article published in December 2013

Electrochemistry at Negative Potentials in Bis(trifluoromethanesulfonyl)amide Ionic Liquids

article by Patrick C. Howlett et al published October 2006 in Zeitschrift fuer Physikalische Chemie

Energy-directed tree search: an efficient systematic algorithm for finding the lowest energy conformation of molecules

scientific article published on 4 April 2007

Experimental and theoretical studies of tetramethoxy-p-benzoquinone: infrared spectra, structural and lithium insertion properties

scholarly article in RSC Advances, vol. 3 no. 41, 2013

Front Cover: Spectroscopic Studies on Photoinduced Reactions of the Anticancer Prodrug, trans,trans,trans -[Pt(N3 )2 (OH)2 (py)2 ] (Chem. Eur. J. 22/2018)

scientific article published on 8 February 2018

Homoleptic 12-coordinate lanthanoids with η2-nitroso ligands

scientific article published on 27 February 2007

Inclusion of More Physics Leads to Less Data: Learning the Interaction Energy as a Function of Electron Deformation Density with Limited Training Data

scientific article published on 17 February 2022

Ionic liquids in electrochemical devices and processes: managing interfacial electrochemistry

scientific article published on 18 October 2007

Liquids intermediate between “molecular” and “ionic” liquids: Liquid Ion Pairs?

scientific article published on 01 October 2007

Mechanisms of low temperature capture and regeneration of CO2 using diamino protic ionic liquids

scientific article

On the components of the dielectric constants of ionic liquids: ionic polarization?

scientific article

On the concept of ionicity in ionic liquids

scientific article published on 31 March 2009

Photo- and solvatochromic properties of nitrobenzospiropyran in ionic liquids containing the [NTf2]- anion

scientific article published on 11 August 2008

Physical Absorption Of CO2 in Protic and Aprotic Ionic Liquids: An Interaction Perspective.

scientific article published on 20 August 2015

Predicting Entropic Effects of Water Mixing with Ionic Liquids Containing Anions of Strong Hydrogen Bonding Ability: Role of the Cation

scientific article published on 02 October 2020

Prediction of lattice energy of benzene crystals: A robust theoretical approach

scientific article published on 24 November 2020

Quantum Chemical Mapping of Initialization Processes in RAFT Polymerization

Quantum Chemical Methods for the Prediction of Energetic, Physical, and Spectroscopic Properties of Ionic Liquids

scientific article published on 31 January 2017

Radical Addition to Thioketones:  Computer-Aided Design of Spin Traps for Controlling Free-Radical Polymerization

scientific article published in November 2006

Should contemporary density functional theory methods be used to study the thermodynamics of radical reactions?

scientific article published on 22 September 2007

Spectroscopic Studies on Photoinduced Reactions of the Anticancer Prodrug, trans,trans,trans -[Pt(N3 )2 (OH)2 (py)2 ]

scientific article published on 8 February 2018

Spectroscopic Studies on Photoinduced Reactions of the Anticancer Prodrug, trans,trans,trans-[Pt(N3)2(OH)2(py)2].

scientific article published on 3 January 2018

The Madelung Constant of Organic Salts

scientific article published on 4 November 2009

The Supramolecular Architecture of Arene Complexes of Bis(polyfluorophenyl)mercurials

scientific article published on 4 September 2008

The effect of descriptor choice in machine learning models for ionic liquid melting point prediction

scientific article published on 01 September 2020

Theoretical and experimental insights into the mechanism of the nucleophilic addition of water and methanol to dicyanonitrosomethanide

scientific article published on 18 November 2010

Towards a Better Understanding of 'Delocalized Charge' in Ionic Liquid Anions

Trends in R−X Bond Dissociation Energies (R = Me, Et,i-Pr,t-Bu; X = H, CH3, OCH3, OH, F): A Surprising Shortcoming of Density Functional Theory

scientific article published in August 2005

Trends in Two- and Three-Body Effects in Multiscale Clusters of Ionic Liquids

scientific article published on 19 December 2016