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Theoretical and Computational Chemistry

Working Paper

Theoretical Bounds on Electron Energy Filtering in Disordered Nanomaterials

Amro Dodin, Brian F. Aull, Roderick R. Kunz, Adam Willard

587

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Theoretical and Computational Chemistry

Working Paper

Modeling the Influence of Correlated Molecular Disorder on the Dynamics of Excitons in Organic Molecular Semiconductors

Chee Kong Lee, Liang Shi, Adam Willard

721

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Physical Chemistry

Working Paper

The Limited Influence of Transference Number on the Performance of Nanoscale Batteries

Kaitlyn Dwelle, Adam Willard

666

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Theoretical and Computational Chemistry

Working Paper

Solving the Trivial Crossing Problem While Preserving the Nodal Symmetry of the Wavefunction

Adam Willard, Elizabeth Lee

436

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Polymer Science

Working Paper

Polymer Metal-Organic Cage Gels Based on Cu24L24 Cuboctahedra: Design, Synthesis, and Additive Manufacturing Enabled by Three-State Photoswitching

Nathan J. Oldenhuis, Peter Qin, Shu Wang, Hong-Zhou Ye, Eric Alt, Adam Willard, Troy Van Voorhis, Stephen Craig, Jeremiah Johnson

1,377

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Catalysis

Working Paper

Bayesian Data Analysis Reveals No Preference for Cardinal Tafel Slopes in CO2 Reduction Electrocatalysis

Aditya Limaye, Joy S. Zeng, Adam Willard, Karthish Manthiram

589

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Physical Chemistry

Working Paper

On the Design of Molecular Excitonic Circuits for Quantum Computing: The Universal Quantum Gates

Maria Castellanos, Amro Dodin, Adam Willard

565

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Materials Science

Working Paper

Epitaxial Dimers and Auger-Assisted De-Trapping in PbS Quantum Dot Solids

Rachel H. Gilmore, Yun Liu, Wenbi Shcherbakov-Wu, Nabeel Dahod, Elizabeth Lee, Mark Weidman, Huashan Li, Joel Jean, Vladimir Bulovic, Adam Willard, Jeffrey C. Grossman, William Tisdale

1,052

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Physical Chemistry

Working Paper

Understanding Attenuated Solvent Reorganization Energies near Electrode Interfaces

Aditya Limaye, Wendu Ding, Adam Willard

614

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Polymer Science

Working Paper

Polymer-Solvent Phase Separation and Criticality in the Formation of Porous Polymeric Solids: A Modeling Study

Adam Willard, Paul E. Teichen

456

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14 results in Adam Willard in Authors: Adam Willard

Theoretical Bounds on Electron Energy Filtering in Disordered Nanomaterials

Modeling the Influence of Correlated Molecular Disorder on the Dynamics of Excitons in Organic Molecular Semiconductors

The Limited Influence of Transference Number on the Performance of Nanoscale Batteries

Solving the Trivial Crossing Problem While Preserving the Nodal Symmetry of the Wavefunction

Polymer Metal-Organic Cage Gels Based on Cu24L24 Cuboctahedra: Design, Synthesis, and Additive Manufacturing Enabled by Three-State Photoswitching

Bayesian Data Analysis Reveals No Preference for Cardinal Tafel Slopes in CO2 Reduction Electrocatalysis

On the Design of Molecular Excitonic Circuits for Quantum Computing: The Universal Quantum Gates

Epitaxial Dimers and Auger-Assisted De-Trapping in PbS Quantum Dot Solids

Understanding Attenuated Solvent Reorganization Energies near Electrode Interfaces

Polymer-Solvent Phase Separation and Criticality in the Formation of Porous Polymeric Solids: A Modeling Study

14 results in Authors: Adam Willard