Barry D Dunietz

Associate Professor

Kent State University

United States

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About

Barry D Dunietz is an Associate Professor at Kent State University in the United States. His research focuses on computational studies of electronic energy transfer, thermally activated delayed fluorescence, and the design of innovative materials for photonic applications. Recent articles explore topics such as dielectric screening effects, charge transfer rates in organic photovoltaic systems, and strategies for enhancing luminescent properties in molecular frameworks.

Articles (17)

Visible light-activatable Pt( iv ) prodrugs harness the upregulated CD36 to facilitate cell entry and killing of drug resistant ovarian cancer cells.

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2023

2-R-1 H -1,3-Benzazaphospholes (R-BAPs) are an interesting class of fluorescent σ 2 P heterocycles containing PC bonds.

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2023

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2023

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2023

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2023

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2023

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2022

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2022

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2022

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2021

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2021

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2021

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2021

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2021

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2021

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2021

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2021

Collaborators (8)

Jessica A. Martinez B.

Teaching Assistant

Rutgers University

UNITED STATES

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Pengzhi Zhang

Houston Methodist

UNITED STATES

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Yao-Rong Zheng

Kent State University

UNITED STATES

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Ariela Kaspi-Kaneti

Assistant Professor of Chemistry

University of La Verne

UNITED STATES

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Matthew Pelton

University of Maryland

UNITED STATES

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Margaret S. Cheung

University of Washington

UNITED STATES

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John D. Protasiewicz

Case Western Reserve University

UNITED STATES

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Hao Shen

Kent State University

UNITED STATES

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Barry D Dunietz

Research Interests

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About

Articles (17)

Visible light-activatable platinum(<scp>iv</scp>) prodrugs harnessing CD36 for ovarian cancer therapy

Luminescent 1<i>H</i>-1,3-benzazaphospholes

Engineering giant excitonic coupling in bioinspired, covalently bridged BODIPY dyads

A Computational Study of the Electronic Energy and Charge Transfer Rates and Pathways in the Tetraphenyldibenzoperiflanthene/Fullerene Interfacial Dyad

Effects of Solvent Dielectric on Thermally Activated Delayed Fluorescence: A Predictive Computational Polarization Consistent Approach

Polarization consistent dielectric screening in polarizable continuum model calculations of solvation energies

Role of Dielectric Screening in Calculating Excited States of Solvated Azobenzene: A Benchmark Study Comparing Quantum Embedding and Polarizable Continuum Model for Representing the Solvent

Correlating Interfacial Charge Transfer Rates with Interfacial Molecular Structure in the Tetraphenyldibenzoperiflanthene/C<sub>70</sub> Organic Photovoltaic System

Solvent Dependent Nuclear Magnetic Resonance Molecular Parameters Based on a Polarization Consistent Screened Range Separated Hybrid Density Functional Theory Framework

CTRAMER: An open-source software package for correlating interfacial charge transfer rate constants with donor/acceptor geometries in organic photovoltaic materials

Enhancing fluorescence and lowering the optical gap through C P doping of a <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si26.svg"><mml:mi>π</mml:mi></mml:math>-conjugated molecular backbone: A computational-based design approach

Electronic Spectra of C60 Films Using Screened Range Separated Hybrid Functionals

Intersystem Crossing in Tetrapyrrolic Macrocycles. A First-Principles Analysis

Achieving Predictive Description of Negative Differential Resistance in Molecular Junctions Using a Range-Separated Hybrid Functional

Cyanide Bridged Platinum-Iron Complexes as Cisplatin Prodrug Systems: Design and Computational Study

Heat flow enhancement in a nanoscale plasmonic junction induced by Kondo resonances and electron-phonon coupling

Simulating energy transfer dynamics in the Fenna-Matthews-Olson complex via the modified generalized quantum master equation

Collaborators (8)

Jessica A. Martinez B.

Pengzhi Zhang

Yao-Rong Zheng

Ariela Kaspi-Kaneti

Matthew Pelton

Margaret S. Cheung

John D. Protasiewicz

Hao Shen

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