List of works - Nicholas F. Chilton

<scp>Hyperion</scp>: A New Computational Tool for Relativistic Ab Initio Hyperfine Coupling

scientific article published on 01 July 2022

A Family of {Cr(III)2Ln(III)2} Butterfly Complexes: Effect of the Lanthanide Ion on the Single-Molecule Magnet Properties

scientific article published on 21 October 2015

A Low-Symmetry Dysprosium Metallocene Single-Molecule Magnet with a High Anisotropy Barrier

scientific article

A double-dysprosocenium single-molecule magnet bound together with neutral ligands

scientific article published on 22 April 2020

A high nuclearity mixed valence {Mn32} complex

scientific article published on 19 April 2011

A large barrier single-molecule magnet without magnetic memory

scientific article published on 01 July 2019

A monometallic lanthanide bis(methanediide) single molecule magnet with a large energy barrier and complex spin relaxation behaviour.

scientific article published on 23 November 2015

A {Cr(III)₂Dy(III)₂} single-molecule magnet: enhancing the blocking temperature through 3d magnetic exchange

scientific article

An electrostatic model for the determination of magnetic anisotropy in dysprosium complexes

scientific article published in January 2013

Analysis of Lanthanide-Radical Magnetic Interactions in Ce(III) 2,2'-Bipyridyl Complexes

scientific article published on 16 February 2017

Anisotropy barrier enhancement via ligand substitution in tetranuclear {CoIII2LnIII2} single molecule magnets

scientific article published on 01 August 2013

Antimony-ligated dysprosium single-molecule magnets as catalysts for stibine dehydrocoupling

scientific article

Assessing crystal field and magnetic interactions in diuranium-μ-chalcogenide triamidoamine complexes with UIV-E-UIV cores (E = S, Se, Te): implications for determining the presence or absence of actinide-actinide magnetic exchange

scientific article published on 5 July 2017

Bis-Monophospholyl Dysprosium Cation Showing Magnetic Hysteresis at 48 K

scientific article published on 05 December 2019

Coordination polymers from a highly flexible alkyldiamine-derived ligand: structure, magnetism and gas adsorption studies

scientific article published on 30 July 2015

Correlating blocking temperatures with relaxation mechanisms in monometallic single-molecule magnets with high energy barriers (Ueff > 600 K)

scientific article published on 08 May 2019

Crown-linked dipyridylamino-triazine ligands and their spin-crossover iron(ii) derivatives: magnetism, photomagnetism and cooperativity

scientific article published on 01 December 2013

Cu(II) Coordination Polymers as Vehicles in the A3 Coupling

scientific article

Design criteria for high-temperature single-molecule magnets.

scientific article

Di- and Tetranuclear Complexes of Bis-Tetradentate Pyrimidine-Based Ligands with All-Methylene- Versus Mixed Methylene/Ethylene-Linked Arms

Direct measurement of dysprosium(III)˙˙˙dysprosium(III) interactions in a single-molecule magnet

scientific article published in Nature Communications

Dispersion force stabilized two-coordinate transition metal-amido complexes of the -N(SiMe3)Dipp (Dipp = C6H3-2,6-Pr(i)2) ligand: structural, spectroscopic, magnetic, and computational studies

scientific article published on 18 November 2013

Electronic structures of bent lanthanide(III) complexes with two N-donor ligands

scientific article published on 18 September 2019

Engineering electronic structure to prolong relaxation times in molecular qubits by minimising orbital angular momentum

scientific article published on 26 July 2019

Evidence of Slow Magnetic Relaxation in Co(AcO)2(py)2(H2O)2

Exploring the Coordination Capabilities of a Family of Flexible Benzotriazole-Based Ligands Using Cobalt(II) Sources

scholarly article by Edward Loukopoulos et al published 11 April 2017 in Crystal Growth & Design

Fast magnetic relaxation in an octahedral dysprosium tetramethyl-aluminate complex

article published in 2014

Field- and temperature-dependent quantum tunnelling of the magnetisation in a large barrier single-molecule magnet

scientific article published in Nature Communications

Heterometallic Tetranuclear [LnIII2CoIII2] Complexes Including Suppression of Quantum Tunneling of Magnetization in the [DyIII2CoIII2] Single Molecule Magnet

scientific article published on 16 October 2012

How the Ligand Field in Lanthanide Coordination Complexes Determines Magnetic Susceptibility Anisotropy, Paramagnetic NMR Shift, and Relaxation Behavior

scientific article published on 15 July 2020

Insights into D4h@metal-symmetry single-molecule magnetism: the case of a dysprosium-bis(boryloxide) complex

scientific article published on 21 December 2020

Investigation into the Effects of a Trigonal-Planar Ligand Field on the Electronic Properties of Lanthanide(II) Tris(silylamide) Complexes (Ln = Sm, Eu, Tm, Yb).

scientific article published in May 2017

Iron(II) Complexes of Two Amine/Imine N5Chelate Ligands Containing a 1,4-Diazepane Core - To Crossover or Not To Crossover

Isolation and electronic structures of derivatized manganocene, ferrocene and cobaltocene anions

scientific article published on 14 December 2020

Large Zero-Field Splittings of the Ground Spin State Arising from Antisymmetric Exchange Effects in Heterometallic Triangles

scientific article published on 15 April 2014

Ligand field influence on the electronic and magnetic properties of quasi-linear two-coordinate iron(ii) complexes

scientific article published on 26 May 2015

Light Lanthanide Metallocenium Cations Exhibiting Weak Equatorial Anion Interactions

scientific article published on 13 May 2019

LnIII2MnIII2 heterobimetallic “butterfly” complexes displaying antiferromagnetic coupling (Ln = Eu, Gd, Tb, Er)

scientific article published on 13 August 2012

Magnetic properties of octa- and heptadeca-nuclear heterometallic CoII–LnIII complexes derived from the ligand 6-chloro-2-hydroxypyridine

Measurement of magnetic exchange in asymmetric lanthanide dimetallics: towards a transferable theoretical framework.

scientific article

Measuring Spin⋅⋅⋅Spin Interactions between Heterospins in a Hybrid [2]Rotaxane

scientific article

Modular [FeIII8MII6]n+ (MII = Pd, Co, Ni, Cu) Coordination Cages.

scientific article

Modulation of slow magnetic relaxation by tuning magnetic exchange in {Cr2Dy2} single molecule magnets

Molecular and electronic structure of terminal and alkali metal-capped uranium(V) nitride complexes

scientific article (publication date: 20 December 2016)

Molecular and electronic structures of donor-functionalized dysprosium pentadienyl complexes

article

Molecular coolers: The case for [CuII5GdIII4]

Molecules Designed to Contain Two Weakly Coupled Spins with a Photoswitchable Spacer

scientific article

Observation of Ferromagnetic Exchange, Spin Crossover, Reductively Induced Oxidation, and Field-Induced Slow Magnetic Relaxation in Monomeric Cobalt Nitroxides

scientific article published on 18 June 2013

On Approaching the Limit of Molecular Magnetic Anisotropy: A Near-Perfect Pentagonal Bipyramidal Dysprosium(III) Single-Molecule Magnet.

scientific article published on 22 November 2016

On the Possibility of Magneto-Structural Correlations: Detailed Studies of Dinickel Carboxylate Complexes

scientific article published on 25 July 2014

PHI: a powerful new program for the analysis of anisotropic monomeric and exchange-coupled polynuclear d- and f-block complexes

scientific article

Partial spin crossover behaviour in a dinuclear iron(ii) triple helicate

scientific article published on 11 October 2011

Periodic trends and hidden dynamics of magnetic properties in three series of triazacyclononane lanthanide complexes

scientific article published on 22 May 2019

Physicochemical Properties of Near-Linear Lanthanide(II) Bis(silylamide) Complexes (Ln = Sm, Eu, Tm, Yb).

scientific article published on 23 May 2016

Planar tetranuclear lanthanide clusters with the Dy4 analogue displaying slow magnetic relaxation

scientific article published on 27 October 2011

Post-Synthetic Monovalent Central-Metal Exchange, Specific I2 Sensing, and Polymerization of a Catalytic [3×3] Grid of [CuII5CuI4L6]⋅(I)2⋅13 H2O

scientific article published on 20 March 2013

Rare-Earth- and Uranium-Mesoionic Carbenes: A New Class of f-Block Carbene Complex Derived from an N-Heterocyclic Olefin

scientific article published on 18 July 2017

Rationalization of Anomalous Pseudocontact Shifts and Their Solvent Dependence in a Series of C3-Symmetric Lanthanide Complexes

scientific article

Redox and acid-base properties of asymmetric non-heme (hydr)oxo-bridged diiron complexes

scientific article published in July 2014

Salts of the two-coordinate homoleptic manganese(I) dialkyl anion [Mn{C(SiMe3)3}2](-) with quenched orbital magnetism.

scientific article

Self-assembled decanuclear Na(I)2Mn(II)4Mn(III)4 complexes: from discrete clusters to 1-D and 2-D structures, with the Mn(II)4Mn(III)4 unit displaying a large spin ground state and probable SMM behaviour

scientific article

Sensitivity of Magnetic Anisotropy in the Solid State for Lanthanide Complexes with Small Crystal Field Splitting

scientific article published on 18 April 2019

Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry

Single molecule magnetism in a μ-phenolato dinuclear lanthanide motif ligated by heptadentate Schiff base ligands

scientific article published on 12 September 2012

Single-Molecule Magnetism in Three Related {CoIII2DyIII2}-Acetylacetonate Complexes with Multiple Relaxation Mechanisms

scientific article published on 29 May 2013

Single-Molecule Magnetism in a Family of {CoIII2DyIII2} Butterfly Complexes: Effects of Ligand Replacement on the Dynamics of Magnetic Relaxation

scientific article published on 21 April 2014

Single-molecule magnetism in {CoIII2DyIII2}-amine-polyalcohol-acetylacetonate complexes: effects of ligand replacement at the DyIII sites on the dynamics of magnetic relaxation

Slow magnetic relaxation in a {EuCu5} metallacrown

scientific article published on 08 January 2019

Spectroscopic and Crystal Field Consequences of Fluoride Binding by [Yb⋅DTMA](3+) in Aqueous Solution

scientific article

Spin Crossover in a 3,5-Bis(2-pyridyl)-1,2,4-triazolate-Bridged Dinuclear Iron(II) Complex [{Fe(NCBH3)(py)}2(μ-L1)2] - Powder versus Single Crystal Study

Structure and magnetic exchange in heterometallic 3d–3d transition metal triethanolamine clusters

scientific article published on 23 November 2011

Structure and magnetism of a mixed-valence octanuclear manganese(ii/iii) cluster derived from carbamoylcyanonitrosomethanide (ccnm)

scientific article published on 19 November 2012

Structure, Magnetic Behavior, and Anisotropy of Homoleptic Trinuclear Lanthanoid 8-Quinolinolate Complexes

scientific article published on 12 February 2014

Structure, Magnetism and Theory of a Family of Nonanuclear CuII5LnIII4-Triethanolamine Clusters Displaying Single-Molecule Magnet Behaviour

scientific article published on 05 July 2011

Studies of hysteresis and quantum tunnelling of the magnetisation in dysprosium(iii) single molecule magnets

scientific article published on 21 May 2019

Synthesis and Electronic Structures of Heavy Lanthanide Metallocenium Cations.

scientific article published on 28 November 2017

Synthesis and characterization of homo- and heterovalent tetra- hexa- hepta- and decanuclear manganese clusters using pyridyl functionalized beta-diketone, carboxylate and triethanolamine ligands

scientific article published on 8 July 2010

Synthesis, structural and magnetic characterisation of iron(ii/iii), cobalt(ii) and copper(ii) cluster complexes of the polytopic ligand: N-(2-pyridyl)-3-carboxypropanamide

scientific article published on 30 July 2013

Synthesis, structural and magnetic studies of an isostructural family of mixed 3d/4f tetranuclear ‘star’ clusters

scientific article published on 20 September 2010

Systematic Study of a Family of Butterfly-Like {M2Ln2} Molecular Magnets (M = MgII, MnIII, CoII, NiII, and CuII; Ln = YIII, GdIII, TbIII, DyIII, HoIII, and ErIII)

scientific article published on 27 May 2015

Tetranuclear Zn/4f coordination clusters as highly efficient catalysts for Friedel-Crafts alkylation

scientific article

The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry

scientific article published in 2023

The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings

The first 4d/4f single-molecule magnet containing a {RuIII2DyIII2} core

scientific article published on 24 December 2014

The first near-linear bis(amide) f-block complex: a blueprint for a high temperature single molecule magnet

scientific article published on 01 January 2015

Theoretical studies on polynuclear {Cu(II)5Gd(III)n} clusters (n = 4, 2): towards understanding their large magnetocaloric effect

scientific article published on 23 January 2015

Three-Coordinate Iron(II) Expanded Ring N-Heterocyclic Carbene Complexes

Trinuclear and tetranuclear manganese clusters derived from cyano(imino(methoxy)methyl)nitrosomethanide (cmnm)

Unprecedented hexagonal bipyramidal single-ion magnets based on metallacrowns

scientific article published on 27 October 2016

Unusual oxidation state distributions observed for two mixed-valence heptanuclear manganese disc-like clusters

scientific article published on 9 July 2012

[MIII2MII3] n+ trigonal bipyramidal cages based on diamagnetic and paramagnetic metalloligands.

scientific article published on 19 May 2017

List of works by Nicholas F. Chilton

<scp>Hyperion</scp>: A New Computational Tool for Relativistic Ab Initio Hyperfine Coupling

A Family of {Cr(III)2Ln(III)2} Butterfly Complexes: Effect of the Lanthanide Ion on the Single-Molecule Magnet Properties

A Low-Symmetry Dysprosium Metallocene Single-Molecule Magnet with a High Anisotropy Barrier

A double-dysprosocenium single-molecule magnet bound together with neutral ligands

A high nuclearity mixed valence {Mn32} complex

A large barrier single-molecule magnet without magnetic memory

A monometallic lanthanide bis(methanediide) single molecule magnet with a large energy barrier and complex spin relaxation behaviour.

A {Cr(III)₂Dy(III)₂} single-molecule magnet: enhancing the blocking temperature through 3d magnetic exchange

An electrostatic model for the determination of magnetic anisotropy in dysprosium complexes

Analysis of Lanthanide-Radical Magnetic Interactions in Ce(III) 2,2'-Bipyridyl Complexes

Anisotropy barrier enhancement via ligand substitution in tetranuclear {CoIII2LnIII2} single molecule magnets

Antimony-ligated dysprosium single-molecule magnets as catalysts for stibine dehydrocoupling

Assessing crystal field and magnetic interactions in diuranium-μ-chalcogenide triamidoamine complexes with UIV-E-UIV cores (E = S, Se, Te): implications for determining the presence or absence of actinide-actinide magnetic exchange

Bis-Monophospholyl Dysprosium Cation Showing Magnetic Hysteresis at 48 K

Coordination polymers from a highly flexible alkyldiamine-derived ligand: structure, magnetism and gas adsorption studies

Correlating blocking temperatures with relaxation mechanisms in monometallic single-molecule magnets with high energy barriers (Ueff > 600 K)

Crown-linked dipyridylamino-triazine ligands and their spin-crossover iron(ii) derivatives: magnetism, photomagnetism and cooperativity

Cu(II) Coordination Polymers as Vehicles in the A3 Coupling

Design criteria for high-temperature single-molecule magnets.

Di- and Tetranuclear Complexes of Bis-Tetradentate Pyrimidine-Based Ligands with All-Methylene- Versus Mixed Methylene/Ethylene-Linked Arms

Direct measurement of dysprosium(III)˙˙˙dysprosium(III) interactions in a single-molecule magnet

Dispersion force stabilized two-coordinate transition metal-amido complexes of the -N(SiMe3)Dipp (Dipp = C6H3-2,6-Pr(i)2) ligand: structural, spectroscopic, magnetic, and computational studies

Electronic structures of bent lanthanide(III) complexes with two N-donor ligands

Engineering electronic structure to prolong relaxation times in molecular qubits by minimising orbital angular momentum

Evidence of Slow Magnetic Relaxation in Co(AcO)2(py)2(H2O)2

Exploring the Coordination Capabilities of a Family of Flexible Benzotriazole-Based Ligands Using Cobalt(II) Sources

Fast magnetic relaxation in an octahedral dysprosium tetramethyl-aluminate complex

Field- and temperature-dependent quantum tunnelling of the magnetisation in a large barrier single-molecule magnet

Heterometallic Tetranuclear [LnIII2CoIII2] Complexes Including Suppression of Quantum Tunneling of Magnetization in the [DyIII2CoIII2] Single Molecule Magnet

How the Ligand Field in Lanthanide Coordination Complexes Determines Magnetic Susceptibility Anisotropy, Paramagnetic NMR Shift, and Relaxation Behavior

Insights into <i>D</i><sub>4h</sub>@metal-symmetry single-molecule magnetism: the case of a dysprosium-bis(boryloxide) complex

Investigation into the Effects of a Trigonal-Planar Ligand Field on the Electronic Properties of Lanthanide(II) Tris(silylamide) Complexes (Ln = Sm, Eu, Tm, Yb).

Iron(II) Complexes of Two Amine/Imine N5Chelate Ligands Containing a 1,4-Diazepane Core - To Crossover or Not To Crossover

Isolation and electronic structures of derivatized manganocene, ferrocene and cobaltocene anions

Large Zero-Field Splittings of the Ground Spin State Arising from Antisymmetric Exchange Effects in Heterometallic Triangles

Ligand field influence on the electronic and magnetic properties of quasi-linear two-coordinate iron(ii) complexes

Light Lanthanide Metallocenium Cations Exhibiting Weak Equatorial Anion Interactions

LnIII2MnIII2 heterobimetallic “butterfly” complexes displaying antiferromagnetic coupling (Ln = Eu, Gd, Tb, Er)

Magnetic properties of octa- and heptadeca-nuclear heterometallic CoII–LnIII complexes derived from the ligand 6-chloro-2-hydroxypyridine

Measurement of magnetic exchange in asymmetric lanthanide dimetallics: towards a transferable theoretical framework.

Measuring Spin⋅⋅⋅Spin Interactions between Heterospins in a Hybrid [2]Rotaxane

Modular [FeIII8MII6]n+ (MII = Pd, Co, Ni, Cu) Coordination Cages.

Modulation of slow magnetic relaxation by tuning magnetic exchange in {Cr2Dy2} single molecule magnets

Molecular and electronic structure of terminal and alkali metal-capped uranium(V) nitride complexes

Molecular and electronic structures of donor-functionalized dysprosium pentadienyl complexes

Molecular coolers: The case for [CuII5GdIII4]

Molecules Designed to Contain Two Weakly Coupled Spins with a Photoswitchable Spacer

Observation of Ferromagnetic Exchange, Spin Crossover, Reductively Induced Oxidation, and Field-Induced Slow Magnetic Relaxation in Monomeric Cobalt Nitroxides

On Approaching the Limit of Molecular Magnetic Anisotropy: A Near-Perfect Pentagonal Bipyramidal Dysprosium(III) Single-Molecule Magnet.

On the Possibility of Magneto-Structural Correlations: Detailed Studies of Dinickel Carboxylate Complexes

PHI: a powerful new program for the analysis of anisotropic monomeric and exchange-coupled polynuclear d- and f-block complexes

Partial spin crossover behaviour in a dinuclear iron(ii) triple helicate

Periodic trends and hidden dynamics of magnetic properties in three series of triazacyclononane lanthanide complexes

Physicochemical Properties of Near-Linear Lanthanide(II) Bis(silylamide) Complexes (Ln = Sm, Eu, Tm, Yb).

Planar tetranuclear lanthanide clusters with the Dy4 analogue displaying slow magnetic relaxation

Post-Synthetic Monovalent Central-Metal Exchange, Specific I2 Sensing, and Polymerization of a Catalytic [3×3] Grid of [CuII5CuI4L6]⋅(I)2⋅13 H2O

Rare-Earth- and Uranium-Mesoionic Carbenes: A New Class of f-Block Carbene Complex Derived from an N-Heterocyclic Olefin

Rationalization of Anomalous Pseudocontact Shifts and Their Solvent Dependence in a Series of C3-Symmetric Lanthanide Complexes

Redox and acid-base properties of asymmetric non-heme (hydr)oxo-bridged diiron complexes

Salts of the two-coordinate homoleptic manganese(I) dialkyl anion [Mn{C(SiMe3)3}2](-) with quenched orbital magnetism.

Self-assembled decanuclear Na(I)2Mn(II)4Mn(III)4 complexes: from discrete clusters to 1-D and 2-D structures, with the Mn(II)4Mn(III)4 unit displaying a large spin ground state and probable SMM behaviour

Sensitivity of Magnetic Anisotropy in the Solid State for Lanthanide Complexes with Small Crystal Field Splitting

Single molecule magnetism in a family of mononuclear β-diketonate lanthanide(iii) complexes: rationalization of magnetic anisotropy in complexes of low symmetry

Single molecule magnetism in a μ-phenolato dinuclear lanthanide motif ligated by heptadentate Schiff base ligands

Single-Molecule Magnetism in Three Related {CoIII2DyIII2}-Acetylacetonate Complexes with Multiple Relaxation Mechanisms

Single-Molecule Magnetism in a Family of {CoIII2DyIII2} Butterfly Complexes: Effects of Ligand Replacement on the Dynamics of Magnetic Relaxation

Single-molecule magnetism in {CoIII2DyIII2}-amine-polyalcohol-acetylacetonate complexes: effects of ligand replacement at the DyIII sites on the dynamics of magnetic relaxation

Slow magnetic relaxation in a {EuCu5} metallacrown

Spectroscopic and Crystal Field Consequences of Fluoride Binding by [Yb⋅DTMA](3+) in Aqueous Solution

Spin Crossover in a 3,5-Bis(2-pyridyl)-1,2,4-triazolate-Bridged Dinuclear Iron(II) Complex [{Fe(NCBH3)(py)}2(μ-L1)2] - Powder versus Single Crystal Study

Structure and magnetic exchange in heterometallic 3d–3d transition metal triethanolamine clusters

Structure and magnetism of a mixed-valence octanuclear manganese(ii/iii) cluster derived from carbamoylcyanonitrosomethanide (ccnm)

Structure, Magnetic Behavior, and Anisotropy of Homoleptic Trinuclear Lanthanoid 8-Quinolinolate Complexes

Structure, Magnetism and Theory of a Family of Nonanuclear CuII5LnIII4-Triethanolamine Clusters Displaying Single-Molecule Magnet Behaviour

Studies of hysteresis and quantum tunnelling of the magnetisation in dysprosium(iii) single molecule magnets

Synthesis and Electronic Structures of Heavy Lanthanide Metallocenium Cations.

Synthesis and characterization of homo- and heterovalent tetra- hexa- hepta- and decanuclear manganese clusters using pyridyl functionalized beta-diketone, carboxylate and triethanolamine ligands

Synthesis, structural and magnetic characterisation of iron(ii/iii), cobalt(ii) and copper(ii) cluster complexes of the polytopic ligand: N-(2-pyridyl)-3-carboxypropanamide

Synthesis, structural and magnetic studies of an isostructural family of mixed 3d/4f tetranuclear ‘star’ clusters