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Electronic and Geometric Structure, Optical Properties, and Excited State Behavior in Atomically Precise Thiolate-Stabilized Noble Metal Nanoclusters

Accounts of chemical research, 2018-12, Vol.51 (12), p.3065-3073

Aikens, Christine M

2018

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Electronic Structure of Ligand-Passivated Gold and Silver Nanoclusters

The journal of physical chemistry letters, 2011-01, Vol.2 (2), p.99-104

Aikens, Christine M

2011

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X-ray Crystal Structure and Theoretical Analysis of Au25-xAgx(SCH2CH2Ph)18(-) Alloy

The journal of physical chemistry letters, 2014-02, Vol.5 (3), p.461-466

2014

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Quantum Mechanical Studies of Large Metal, Metal Oxide, and Metal Chalcogenide Nanoparticles and Clusters

Chemical reviews, 2015-06, Vol.115 (12), p.6112-6216

2015

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Effects of Core Distances, Solvent, Ligand, and Level of Theory on the TDDFT Optical Absorption Spectrum of the Thiolate-Protected Au25 Nanoparticle

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2009-10, Vol.113 (40), p.10811-10817

Aikens, Christine M

2009

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[Ag48(CC t Bu)20(CrO4)7]: An Atomically Precise Silver Nanocluster Co-protected by Inorganic and Organic Ligands

Journal of the American Chemical Society, 2019-03, Vol.141 (10), p.4460-4467

2019

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Correlating the Crystal Structure of A Thiol-Protected Au25 Cluster and Optical Properties

Journal of the American Chemical Society, 2008-05, Vol.130 (18), p.5883-5885

2008

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Electronic structure methods for studying surface-enhanced Raman scattering

Chemical Society reviews, 2008-01, Vol.37 (5), p.1061-1073

2008

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Ligand Exchange Mechanism on Thiolate Monolayer Protected Au25(SR)18 Nanoclusters

Journal of physical chemistry. C, 2015-08

2015

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Geometric and Electronic Structure of Au25(SPhX)18 − (X = H, F, Cl, Br, CH3, and OCH3)

The journal of physical chemistry letters, 2010-09, Vol.1 (17), p.2594-2599

Aikens, Christine M

2010

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Deciphering the dual emission in the photoluminescence of Au14Cd(SR)12: A theoretical study using TDDFT and TDDFT + TB

The Journal of chemical physics, 2021-08, Vol.155 (7), p.074302-074302

2021

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Reaction Pathways for Water Oxidation to Molecular Oxygen Mediated by Model Cobalt Oxide Dimer and Cubane Catalysts

Journal of physical chemistry. C, 2015-05, Vol.119 (20), p.11072-11085

2015

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Time-Dependent Density Functional Theory Studies of Optical Properties of Ag Nanoparticles: Octahedra, Truncated Octahedra, and Icosahedra

Journal of physical chemistry. C, 2012-05, Vol.116 (18), p.10356-10367

2012

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Understanding the Effect of Doping on Energetics and Electronic Structure for Au25, Ag25, and Au38 Clusters

Journal of physical chemistry. C, 2019-04, Vol.123 (14), p.9516-9527

2019

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From atom-precise nanoclusters to superatom materials

The Journal of chemical physics, 2022-05, Vol.156 (17), p.170401-170401

2022

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Origin of Photoluminescence of Ag25(SR)18 – Nanoparticles: Ligand and Doping Effect

Journal of physical chemistry. C, 2018-02, Vol.122 (4), p.2440-2447

2018

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Origin and TDDFT Benchmarking of the Plasmon Resonance in Acenes

Journal of physical chemistry. C, 2013-10, Vol.117 (41), p.21466-21475

2013

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Quantum coherent plasmon in silver nanowires: a real-time TDDFT study

The Journal of chemical physics, 2014-06, Vol.140 (24), p.244705-244705

2014

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Photoluminescence Origin of Au38(SR)24 and Au22(SR)18 Nanoparticles: A Theoretical Perspective

Journal of physical chemistry. C, 2017-07, Vol.121 (28), p.15416-15423

2017

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Chiral Noble Metal Nanoparticles and Nanostructures

Particle & particle systems characterization, 2019-05, Vol.36 (5), p.n/a

2019

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Incremental Solvation of Nonionized and Zwitterionic Glycine

Journal of the American Chemical Society, 2006-10, Vol.128 (39), p.12835-12850

2006

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Toward quantitative electronic structure in small gold nanoclusters

The Journal of chemical physics, 2021-07, Vol.155 (1), p.014301-014301

2021

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Chiral Electronic Transitions in Fluorescent Silver Clusters Stabilized by DNA

ACS nano, 2014-07, Vol.8 (7), p.6883-6892

2014

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A first glance into mixed phosphine-stibine moieties as protecting ligands for gold clusters

Nanoscale, 2023-04, Vol.15 (15), p.6934-694

2023

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Deciphering the Ligand Exchange Process on Thiolate Monolayer Protected Au38(SR)24 Nanoclusters

Journal of physical chemistry. C, 2016-07, Vol.120 (27), p.14948-14961

2016

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Electronic and Geometric Structure, Optical Properties, and Excited State Behavior in Atomically Precise Thiolate-Stabilized Noble Metal Nanoclusters

Electronic Structure of Ligand-Passivated Gold and Silver Nanoclusters

X-ray Crystal Structure and Theoretical Analysis of Au25-xAgx(SCH2CH2Ph)18(-) Alloy

Quantum Mechanical Studies of Large Metal, Metal Oxide, and Metal Chalcogenide Nanoparticles and Clusters

Effects of Core Distances, Solvent, Ligand, and Level of Theory on the TDDFT Optical Absorption Spectrum of the Thiolate-Protected Au25 Nanoparticle

[Ag48(CC t Bu)20(CrO4)7]: An Atomically Precise Silver Nanocluster Co-protected by Inorganic and Organic Ligands

Correlating the Crystal Structure of A Thiol-Protected Au25 Cluster and Optical Properties

Electronic structure methods for studying surface-enhanced Raman scattering

Ligand Exchange Mechanism on Thiolate Monolayer Protected Au25(SR)18 Nanoclusters

Geometric and Electronic Structure of Au25(SPhX)18 − (X = H, F, Cl, Br, CH3, and OCH3)

Deciphering the dual emission in the photoluminescence of Au14Cd(SR)12: A theoretical study using TDDFT and TDDFT + TB

Reaction Pathways for Water Oxidation to Molecular Oxygen Mediated by Model Cobalt Oxide Dimer and Cubane Catalysts

Time-Dependent Density Functional Theory Studies of Optical Properties of Ag Nanoparticles: Octahedra, Truncated Octahedra, and Icosahedra

Understanding the Effect of Doping on Energetics and Electronic Structure for Au25, Ag25, and Au38 Clusters

From atom-precise nanoclusters to superatom materials

Origin of Photoluminescence of Ag25(SR)18 – Nanoparticles: Ligand and Doping Effect

Origin and TDDFT Benchmarking of the Plasmon Resonance in Acenes

Quantum coherent plasmon in silver nanowires: a real-time TDDFT study

Photoluminescence Origin of Au38(SR)24 and Au22(SR)18 Nanoparticles: A Theoretical Perspective

Chiral Noble Metal Nanoparticles and Nanostructures

Incremental Solvation of Nonionized and Zwitterionic Glycine

Toward quantitative electronic structure in small gold nanoclusters

Chiral Electronic Transitions in Fluorescent Silver Clusters Stabilized by DNA

A first glance into mixed phosphine-stibine moieties as protecting ligands for gold clusters

Deciphering the Ligand Exchange Process on Thiolate Monolayer Protected Au38(SR)24 Nanoclusters

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