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Heath D. Watts, Ph.D.

Affiliations: 
2012 Pennsylvania State University, State College, PA, United States 
Area:
Geochemistry, Molecular Chemistry, General Biophysics
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James D. Kubicki grad student 2012 Penn State
 (Application of density functional theory calculations to elucidate the structure of lignin linkages and the intermolecular interactions among proxies of lignin, hemicellulose, and cellulose.)

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Publications

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Watts HD, Kubicki JD, Kabengi N. (2022) Connecting Thermodynamics of Alkali Ion Exchange on the Quartz (101) Surface with Density Functional Theory Calculations. The Journal of Physical Chemistry. A
Watts HD, O'Day PA, Kubicki JD. (2019) Gibbsite (100) and Kaolinite (100) Sorption of Cadmium (II): A Density Functional Theory and XANES Study of Structures and Energies. The Journal of Physical Chemistry. A
Kubicki J, Watts H. (2019) Quantum Mechanical Modeling of the Vibrational Spectra of Minerals with a Focus on Clays Minerals. 9: 141
Diehl BG, Watts HD, Kubicki JD, et al. (2019) Correction to: Towards lignin-protein crosslinking: amino acid adducts of a lignin model quinone methide Cellulose. 26: 7025-7025
Yang H, Watts HD, Gibilterra V, et al. (2018) Quantum Calculations on Plant Cell Wall Component Interactions. Interdisciplinary Sciences, Computational Life Sciences
Kubicki JD, Watts HD. (2018) Reaction Mechanisms and Solid–Gas Phase Reactions: Theory and Density Functional Theory Simulations Reviews in Mineralogy and Geochemistry. 84: 85-101
Watts HD, Tribe L, Kubicki JD. (2014) Arsenic adsorption onto minerals: Connecting experimental observations with density functional theory calculations Minerals. 4: 208-240
Shklyaev OE, Kubicki JD, Watts HD, et al. (2014) Constraints on Iβ cellulose twist from DFT calculations of 13C NMR chemical shifts Cellulose. 21: 3979-3991
Watts HD, Mohamed MNA, Kubicki JD. (2014) Erratum to: A DFT study of vibrational frequencies and 13C NMR chemical shifts of model cellulosic fragments as a function of size Cellulose. 21: 2181-2181
Diehl BG, Watts HD, Kubicki JD, et al. (2014) Towards lignin-protein crosslinking: Amino acid adducts of a lignin model quinone methide Cellulose. 21: 1395-1407
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