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List of works by Patricia Anne Hunt

(Invited) Understanding Transport Properties of Ionic Liquids By Targeted Modifications of Ion Structures

scientific article published on 9 October 2022

A physicochemical investigation of ionic liquid mixtures.

scientific article

A step towards the a priori design of ionic liquids

article by Heiko Niedermeyer et al published 2013 in Physical Chemistry Chemical Physics

A structural investigation of ionic liquid mixtures

scientific article

An OHD-RIKES and simulation study comparing a benzylmethylimidazolium ionic liquid with an equimolar mixture of dimethylimidazolium and benzene

scientific article published on 01 April 2015

Anion and ether group influence in protic guanidinium ionic liquids

scientific article published in 2023

Atomic charges of sulfur in ionic liquids: experiments and calculations ⬇️

scientific article published on 25 October 2017

Azoniaspiro salts: towards bridging the gap between room-temperature ionic liquids and molten salts

scientific article

Back matter

Base-induced reversible H2 addition to a single Sn(ii) centre

scientific article published on 18 September 2018

Bi(III) halometallate ionic liquids: Interactions and speciation

scientific article published in 2021

Bypassing a highly unstable frustrated Lewis pair: dihydrogen cleavage by a thermally robust silylium-phosphine adduct.

scientific article published in October 2014

Characterising the Electronic Structure of Ionic Liquids: An Examination of the 1-Butyl-3-Methylimidazolium Chloride Ion Pair

article by Patricia A. Hunt et al published 6 September 2006 in Chemistry—A European Journal

Charge transfer and polarisability in ionic liquids: a case study

scientific article published in 2022

Competitive pi interactions and hydrogen bonding within imidazolium ionic liquids

Conformational design concepts for anions in ionic liquids

scientific article published on 7 July 2020

Cooperativity in ionic liquids

Curled cation structures accelerate the dynamics of ionic liquids

scientific article published in 2021

Dihydroazulene/vinylheptafulvene photochromism: a model for one-way photochemistry via a conical intersection

scientific article published in February 2002

Doubly ionic hydrogen bond interactions within the choline chloride-urea deep eutectic solvent

scientific article published on 22 June 2016

Electron spectroscopy of ionic liquids: experimental identification of atomic orbital contributions to valence electronic structure

scientific article published on 01 September 2019

Ether functionalisation, ion conformation and the optimisation of macroscopic properties in ionic liquids

scientific article published on 13 October 2020

Evaluating excited state atomic polarizabilities of chromophores.

scientific article published in March 2018

Experimental validation of calculated atomic charges in ionic liquids ⬇️

scientific article published on 01 May 2018

Guanidinium solvents with exceptional hydrogen bond donating abilities

scientific article published in 2022

Heavier Group 2 Metals and Intermolecular Hydroamination: A Computational and Synthetic Assessment

scientific article published on 01 September 2009

Hydrogen Bonding in 1-Butyl- and 1-Ethyl-3-methylimidazolium Chloride Ionic Liquids

Hydrogen bonding and π-π interactions in imidazolium-chloride ionic liquid clusters

scientific article published on 01 June 2015

Hydrogen bonding in ionic liquids

scientific article published on March 2015

Hydrophosphination of Styrene and Polymerization of Vinylpyridine: A Computational Investigation of Calcium-Catalyzed Reactions and the Role of Fluxional Noncovalent Interactions ⬇️

scientific article published on 14 December 2016

Intramolecular electron transfer in bis(methylene) adamantyl radical cation: a case study of diabatic trapping

scientific article

Ionic liquids: not always innocent solvents for cellulose ⬇️

scientific article published in 2015

Jahn-Teller Distortions in Molecules Containing Group 15 Elements

1998 doctoral thesis by Patricia Anne Hunt at University of Auckland

Lewis and Brønsted multifunctionality: an unusual heterocycle from the reaction of bis(pentafluorophenyl)borinic acid with nitriles.

scientific article published on 10 February 2006

Linking electronic and molecular structure: insight into aqueous chloride solvation

scientific article

Linking the structures, free volumes, and properties of ionic liquid mixtures

scientific article published on 11 July 2017

Mixtures of ionic liquids

scientific article published on December 2012

Molecular Structure and Dynamics

Molecular features contributing to the lower viscosity of phosphonium ionic liquids compared to their ammonium analogues

scientific article published on 17 July 2015

NEXAFS spectroscopy of ionic liquids: experiments versus calculations ⬇️

scientific article

Non-Adiabatic Direct Dynamics Study of Chromium Hexacarbonyl Photodissociation ⬇️

scientific article published on 15 October 2002

Nonadiabatic Dynamics: A Comparison of Surface Hopping Direct Dynamics with Quantum Wavepacket Calculations ⬇️

scientific article published on 10 January 2003

Noncovalent Interactions in Catalysis ⬇️

On the position of the highest occupied molecular orbital in aqueous solutions of simple ions

scientific article published on 01 September 2005

Organolanthanide mediated catalytic cycles: a computational perspective

scientific article published on 12 April 2007

Probing the Photochemical Funnel of a Retinal Chromophore Model via Zero-Point Energy Sampling Semiclassical Dynamics

Quantum Chemical Modeling of Hydrogen Bonding in Ionic Liquids

scientific article

Quantum Chemical Modeling of Hydrogen Bonding in Ionic Liquids

scientific article published in 2017

Resonant X-ray photoelectron spectroscopy: identification of atomic contributions to valence states ⬇️

scientific article published in 2022

Salts dissolved in salts: ionic liquid mixtures

Separation and concentration of CO2 from air using a humidity-driven molten-carbonate membrane ⬇️

scientific article published on 19 July 2024

Solubility of alkali metal halides in the ionic liquid [C4C1im][OTf].

scientific article

Stictamycin, an Aromatic Polyketide Antibiotic Isolated from a New Zealand Lichen-Sourced Streptomyces Species

scientific article published on 16 February 2023

Structural and Dynamic Properties of the New Alternative Refrigerant 2,3,3,3-Tetrafluoro-1-propene (HFO-1234yf) in the Liquid State ⬇️

scientific article published on December 7, 2010

Structural characterization of the 1-butyl-3-methylimidazolium chloride ion pair using ab initio methods.

scientific article published in February 2006

Structure and dynamics of ionic liquids: general discussion

scientific article

Surface Enrichment in Equimolar Mixtures of Non-Functionalized and Functionalized Imidazolium-Based Ionic Liquids

scientific article published on 12 April 2018

Surface thermodynamics of planar, cylindrical, and spherical vapour-liquid interfaces of water.

scientific article published in March 2015

Synthesis and characterisation of luminescent fluorinated organoboron compounds

scientific article published on 28 February 2007

Systematic control of photochemistry: the dynamics of photoisomerization of a model cyanine dye.

scientific article

The Structure of Imidazolium-Based Ionic Liquids: Insights From Ion-Pair Interactions ⬇️

scientific article published in 2007

The impact of anion electronic structure: similarities and differences in imidazolium based ionic liquids

scientific article published on 12 June 2014

The impact of ionic liquids on the coordination of anions with solvatochromic copper complexes.

scientific article published on 5 September 2017

The importance of timescale for hydrogen bonding in imidazolium chloride ionic liquids

The simulation of imidazolium-based ionic liquids† ⬇️

scientific article published in January 2006

Thermal decomposition of carboxylate ionic liquids: trends and mechanisms

scientific article published on 30 October 2013

Thermal versus electronic broadening in the density of states of liquid water ⬇️

scientific article published in July 2003

Trends in Inversion Barriers of Group 15 Compounds. 3. Are Fluorinated Pyridone Derivatives Planar or Nonplanar? ⬇️

scientific article published on November 14, 1997

Ultrafast Radiationless Deactivation of Organic Dyes: Evidence for a Two-State Two-Mode Pathway in Polymethine Cyanines

scientific article published in 2000

Understanding siloxane functionalised ionic liquids

scientific article published on 27 January 2010

Understanding the polarity of ionic liquids

scientific article published on 22 August 2011

Unravelling ionic liquid solvent effects for a non-polar Cope rearrangement reaction

scientific article published in 2024

Water droplet excess free energy determined by cluster mitosis using guided molecular dynamics.

scientific article published on December 2015

Why are ionic liquid ions mainly associated in water? A Car-Parrinello study of 1-ethyl-3-methyl-imidazolium chloride water mixture

scientific article

Why does a reduction in hydrogen bonding lead to an increase in viscosity for the 1-butyl-2,3-dimethyl-imidazolium-based ionic liquids?

scientific article published on 23 March 2007

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