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Physical Chemistry

Working Paper

An Octanol Hinge Opens the Door to Water Transport

Zhu Liu, Aurora Clark

Version 3 posted 03 September 2020

923

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Theoretical and Computational Chemistry

Working Paper

A Geometric Measure Theory Approach to Identify Complex Structural Features of Soft Matter Surfaces

Enrique Alvarado, Zhu Liu, Michael J. Servis, Bala Krishnamoorthy, Aurora Clark

Version 1 posted 17 March 2020

738

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Physical Chemistry

Working Paper

The Effect of Ions on the Optical Absorption Spectra of Aqueously Solvated Chromophores

Sapana Soni, Tim J. Zuehlsdorff, Michael J. Servis, Christine Isborn, Aurora Clark

Version 1 posted 20 May 2019

758

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Inorganic Chemistry

Working Paper

Competitive Interactions at Electrolyte/Octanol Interfaces - A Molecular Perspective

Nitesh Kumar, Michael J. Servis, Zhu Liu, Aurora Clark

Version 1 posted 10 January 2020

498

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Theoretical and Computational Chemistry

Working Paper

Persistent Homology Metrics Reveal Quantum Fluctuations and Reactive Atoms in Path Integral Dynamics

Yunfeng Hu, Phonemany Ounkham, Ondrej Marsalek, Thomas E. Markland, Bala Krishnamoorthy, Aurora Clark

Version 1 posted 21 January 2021

357

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Theoretical and Computational Chemistry

Review

Modulating Aggregation in Microemulsions: The Dispersion by Competitive Interaction Model

Biswajit Sadhu, Aurora Clark

Version 2 posted 29 August 2022

279

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Inorganic Chemistry

Working Paper

Rethinking the Magnetic Properties of Lepidocrocite: A Density Functional Theory and Cluster Expansion Study

Daniel Pope, Aurora Clark, Micah Prange, Kevin Rosso

Version 1 posted 25 February 2020

640

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Theoretical and Computational Chemistry

Working Paper

Behavior of Linear and Nonlinear Dimensionality Reduction for Collective Variable Identication of Small Molecule Solution-Phase Reactions

Hung Le, Sushant Kumar, Nathan May, Ernesto Martinez-Baez, Ravishankar Sundararaman, Bala Krishnamoorthy, Aurora Clark

Version 1 posted 21 September 2021

331

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Chemical Engineering and Industrial Chemistry

Working Paper

Molecular Dynamics and Network Analysis Reveal the Contrasting Roles of Polar Solutes Within Organic Phase Amphiphile Aggregation

Biswajit Sadhu, Aurora E. Clark

Version 3 posted 28 January 2022

602

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Physical Chemistry

Working Paper

Uranyl Speciation in the Presence of Specific Ion Gradients at the Electrolyte/Organic Interface

Nitesh Kumar, Michael J. Servis, Aurora Clark

Version 1 posted 15 April 2021

299

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Refine Search

27 results in Aurora Clark in Authors: Aurora Clark

An Octanol Hinge Opens the Door to Water Transport

A Geometric Measure Theory Approach to Identify Complex Structural Features of Soft Matter Surfaces

The Effect of Ions on the Optical Absorption Spectra of Aqueously Solvated Chromophores

Competitive Interactions at Electrolyte/Octanol Interfaces - A Molecular Perspective

Persistent Homology Metrics Reveal Quantum Fluctuations and Reactive Atoms in Path Integral Dynamics

Modulating Aggregation in Microemulsions: The Dispersion by Competitive Interaction Model

Rethinking the Magnetic Properties of Lepidocrocite: A Density Functional Theory and Cluster Expansion Study

Behavior of Linear and Nonlinear Dimensionality Reduction for Collective Variable Identi cation of Small Molecule Solution-Phase Reactions

Molecular Dynamics and Network Analysis Reveal the Contrasting Roles of Polar Solutes Within Organic Phase Amphiphile Aggregation

Uranyl Speciation in the Presence of Specific Ion Gradients at the Electrolyte/Organic Interface

27 results in Authors: Aurora Clark

Behavior of Linear and Nonlinear Dimensionality Reduction for Collective Variable Identication of Small Molecule Solution-Phase Reactions