Author

Timothy A. Barckholtz

Observed names: Barckholtz, Timothy A., T. Barckholtz, TIMOTHY A. BARCKHOLTZ, Timothy A Barckholtz

Observed institutions: University of North Carolina at Chapel Hill, University of Southern California, National Institute of Standards and Technology, Joint Institute for Laboratory Astrophysics, University of Colorado Boulder, The Ohio State University, Trinity University, University of Delaware, ExxonMobil (United States)

ORCID: 0000-0003-2219-9690

Observed ORCID: 0000-0003-2219-9690

OpenAlex ID: A5076868551

Quantitative insights about molecules exhibiting Jahn-Teller and related effects

1998 · Timothy A. Barckholtz, Terry A. Miller · International Reviews in Physical Chemistry · 229

C−H and N−H Bond Dissociation Energies of Small Aromatic Hydrocarbons

1999 · Cynthia Barckholtz, Timothy A. Barckholtz, et al. · Journal of the American Chemical Society · 179

Laboratory demonstration of the stability of CO2 hydrates in deep-oceanic sediments

2021 · M Fahed Qureshi, Junjie Zheng, et al. · Chemical Engineering Journal · 169

CO2 hydrate stability in oceanic sediments under brine conditions

2022 · M Fahed Qureshi, Himanshu Khandelwal, et al. · Energy · 164

Effect of l -Tryptophan in Promoting the Kinetics of Carbon Dioxide Hydrate Formation

2020 · Himanshu Khandelwal, M. Fahed Qureshi, et al. · Energy & Fuels · 144

On the Possible Structures of Mn 2 (CO) 8 : Theoretical Support for an Unprecedented Asymmetric Unbridged Isomer

1998 · Timothy A. Barckholtz, Bruce E. Bursten · Journal of the American Chemical Society · 125

Evaluating liquid CO2 hydrate formation kinetics, morphology, and stability in oceanic sediments on a lab scale using top injection

2023 · Vikas Dhamu, M. Fahed Qureshi, et al. · Chemical Engineering Journal · 123

Explorations of conical intersections and their ramifications for chemistry through the Jahn–Teller effect

2002 · Brian E. Applegate, Timothy A. Barckholtz, et al. · Chemical Society Reviews · 99

CO 2 Hydrate Formation Kinetics and Morphology Observations Using High-Pressure Liquid CO 2 Applicable to Sequestration

2022 · M. Fahed Qureshi, Vikas Dhamu, et al. · Energy & Fuels · 96

Investigating High-Pressure Liquid CO2 Hydrate Formation, Dissociation Kinetics, and Morphology in Brine and Freshwater Static Systems

2023 · Vikas Dhamu, M. Fahed Qureshi, et al. · Energy & Fuels · 93

The Jahn–Teller and related effects in the cyclopentadienyl radical. I. The ab initio calculation of spectroscopically observable parameters

2001 · Brian E. Applegate, Terry A. Miller, et al. · The Journal of Chemical Physics · 80

A Mechanistic Study of the Reactions of H, O (3P), and OH with Monocyclic Aromatic Hydrocarbons by Density Functional Theory

2000 · Cynthia Barckholtz, Timothy A. Barckholtz, et al. · The Journal of Physical Chemistry A · 72

Molten carbonate fuel cells for simultaneous CO2 capture, power generation, and H2 generation

2022 · Timothy A. Barckholtz, Kevin M. Taylor, et al. · Applied Energy · 61

The Calculation of Spectroscopic Jahn−Teller Parameters by ab Initio Methods

1999 · Timothy A. Barckholtz, Terry A. Miller · The Journal of Physical Chemistry A · 58

Role of Germanium in the Formation of Double Four Rings in Zeolites

2007 · Preeti Kamakoti, Timothy A. Barckholtz · The Journal of Physical Chemistry C · 57

Magnesium-Promoted Rapid Nucleation of Carbon Dioxide Hydrates

2021 · Aritra Kar, Palash Vadiraj Acharya, et al. · ACS Sustainable Chemistry & Engineering · 48

Molten Carbonate Fuel Cell Performance for CO 2 Capture from Natural Gas Combined Cycle Flue Gas

2020 · Jonathan Rosen, Timothy Geary, et al. · Journal of The Electrochemical Society · 46

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Thermal Decomposition of Ethylene Oxide: Potential Energy Surface, Master Equation Analysis, and Detailed Kinetic Modeling

2005 · Ameya Joshi, Xiaoqing You, et al. · The Journal of Physical Chemistry A · 43

Low-carbon hydrogen via integration of steam methane reforming with molten carbonate fuel cells at low fuel utilization

2021 · Stefano Consonni, Luca Mastropasqua, et al. · Advances in Applied Energy · 38

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Density functional calculations of dinuclear organometallic carbonyl complexes. Part I: metalmetal and metalCO bond energies

2000 · Timothy A. Barckholtz, Bruce E. Bursten · Journal of Organometallic Chemistry · 36

Diffusion-based modeling of film growth of hydrates on gas-liquid interfaces

2021 · Aritra Kar, Awan Bhati, et al. · Chemical Engineering Science · 35

ZEKE Spectroscopy of the Organometallic Radicals MgCH3 and ZnCH3: Construction of a High-Resolution “Experimental” Molecular Orbital Diagram

1999 · Timothy A. Barckholtz, David E. Powers, et al. · Journal of the American Chemical Society · 33

Genetic Algorithm Driven Force Field Parameterization for Molten Alkali-Metal Carbonate and Hydroxide Salts

2020 · Anirban Mondal, Jeffrey M. Young, et al. · Journal of Chemical Theory and Computation · 31

Process analysis of molten carbonate fuel cells in carbon capture applications

2020 · D. Bove, E. Audasso, et al. · International Journal of Hydrogen Energy · 28

Experimental and Modeling Investigation of CO3=/OH– Equilibrium Effects on Molten Carbonate Fuel Cell Performance in Carbon Capture Applications

2021 · Timothy A. Barckholtz, Heather Elsen, et al. · Frontiers in Energy Research · 27

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Works count: 55

Citation count: 2,261

H-index: 25

I10-index: 33