Thomas Markland

Associate Professor

Stanford University

United States

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About

Dr. Thomas Markland is an Associate Professor at Stanford University, specializing in the fields of theoretical and computational chemistry. His recent research includes elucidating proton transport pathways, heterogeneous dynamics of protons in aqueous solutions, and the application of machine learning to predict optical spectra. Dr. Markland's work also involves examining excited state diabatization and quantum effects in ionic solutions.

Articles (6)

Year:

2020

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2020

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2020

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2020

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2020

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2020

Collaborators (1)

Andrés Montoya-Castillo

Assistant Professor

University of Colorado Boulder

UNITED STATES

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Thomas Markland

Research Interests

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Articles (6)

Excited state diabatization on the cheap using DFT: Photoinduced electron and hole transfer

On the advantages of exploiting memory in Markov state models for biomolecular dynamics

Elucidating the Proton Transport Pathways in Liquid Imidazole with First-Principles Molecular Dynamics

Resolving Heterogeneous Dynamics of Excess Protons in Aqueous Solution with Rate Theory

Exploiting Machine Learning to Efficiently Predict Multidimensional Optical Spectra in Complex Environments

Quantum kinetic energy and isotope fractionation in aqueous ionic solutions

Collaborators (1)

Andrés Montoya-Castillo

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