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Physical Chemistry

Working Paper

Orbital-Dependent Photodynamics of Strongly Correlated Clusters

Jacob Garcia, Scott Sayres

Version 1 posted 29 October 2021

128

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Inorganic Chemistry

Working Paper

Gold(III) Aryl Complexes as Reagents for Constructing Hybrid Peptide-Based Assemblies via Cysteine S-Arylation

Julia M. Stauber, Arnold L. Rheingold, Alexander Spokoyny

Version 1 posted 17 December 2020

704

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Theoretical and Computational Chemistry

Working Paper

Improved Configurational Sampling Protocol for Large Atmospheric Molecular Clusters

Haide Wu, Morten Engsvang, Yosef Knattrup, Jakub Kubečka, Jonas Elm

Version 1 posted 04 September 2023

103

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Assessment of Anharmonicities in Clusters: Developing and Validating a Minimum-Information Partition Function

Roope Halonen

Version 2 posted 03 May 2024

103

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Organometallic Chemistry

Working Paper

Pincer-ligated Iridium Complexes with Low-Field Ancillary Ligands: Complexes of (iPrPCP)IrCl2 and Comparison with (iPrPCP)IrHCl

Ashish Parihar, Thomas J. Emge, Alan S. Goldman

Version 1 posted 20 December 2023

218

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1

Citations

Inorganic Chemistry

Working Paper

Snapshots of Ce70 Toroid Assembly from Solids and Solution

Ian Colliard, Jessica C. Brown, Dylan B. Fast, Ashleigh Sockwell, Amy Hixon, May Nyman

Version 1 posted 19 April 2021

314

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Theoretical and Computational Chemistry

Working Paper

Highly Accurate Many-Body Potentials for Simulations of N2O5 in Water: Benchmarks, Development, and Validation

Vinicius Cruzeiro, Eleftherios Lambros, Marc Riera, Ronak Roy, Francesco Paesani, Andreas Goetz

Version 1 posted 21 January 2021

436

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Nanoscience

Working Paper

A General Method for Structure Prediction of Metal-Ligand Interfaces of Hybrid Nanoparticles

Sami Malola, Paavo Nieminen, Joonas Hamalainen, Tommi Karkkainen, Hannu Hakkinen, Antti Pihlajamaki

Version 2 posted 19 June 2019

1,054

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Inorganic Chemistry

Working Paper

Kinetic Versus Thermodynamic Metalation Enables Synthesis of Isostructural Homo- and Heterometallic Trinuclear Clusters

Sung-Min Hyun, Apoorva Upadhyay, Anuvab Das, Corey Burns, Siyoung Sung, Jeremy Beaty, Nattamai Bhuvanesh, Michael Nippe, David Powers

Version 1 posted 02 April 2020

508

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Physical Chemistry

Working Paper

Molecular Characterization of the Surface Excess Charge Layer in Droplets

Victor Kwan, Styliani Consta

Version 3 posted 29 June 2020

864

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Refine Search

26 results in clusters in Keywords: clusters

Orbital-Dependent Photodynamics of Strongly Correlated Clusters

Gold(III) Aryl Complexes as Reagents for Constructing Hybrid Peptide-Based Assemblies via Cysteine S-Arylation

Improved Configurational Sampling Protocol for Large Atmospheric Molecular Clusters

Assessment of Anharmonicities in Clusters: Developing and Validating a Minimum-Information Partition Function

Pincer-ligated Iridium Complexes with Low-Field Ancillary Ligands: Complexes of (iPrPCP)IrCl2 and Comparison with (iPrPCP)IrHCl

Snapshots of Ce70 Toroid Assembly from Solids and Solution

Highly Accurate Many-Body Potentials for Simulations of N2O5 in Water: Benchmarks, Development, and Validation

A General Method for Structure Prediction of Metal-Ligand Interfaces of Hybrid Nanoparticles

Kinetic Versus Thermodynamic Metalation Enables Synthesis of Isostructural Homo- and Heterometallic Trinuclear Clusters

Molecular Characterization of the Surface Excess Charge Layer in Droplets

26 results in Keywords: clusters