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Langmuir : the ACS Journal of Surfaces and Colloids
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December 22, 2021
Effect of Concrete Composition on the Thermodynamic Binding of Dopamine: A DFT Study
Glen R Jenness, Manoj K Shukla
Physical Chemistry Chemical Physics : PCCP
|
April 24, 2010
Benchmark calculations of water-acene interaction energies: Extrapolation to the water-graphene limit and assessment of dispersion-corrected DFT methods
Glen R Jenness, Ozan Karalti, Kenneth D Jordan
Physical Chemistry Chemical Physics : PCCP
|
July 4, 2018
DFT investigation on the adsorption of munition compounds on α-Fe<sub>2</sub>O<sub>3</sub>: similarity and differences with α-Al<sub>2</sub>O<sub>3</sub>
Glen R Jenness, Jennifer Seiter, Manoj K Shukla
Journal of Chemical Theory and Computation
|
October 29, 2020
Adventures in DFTB: Toward an Automatic Parameterization Scheme
Glen R Jenness, Caitlin G Bresnahan, Manoj K Shukla
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
February 17, 2026
Adsorption of Isolated and Hydrated Linear Per- and Polyfluoroalkyl Substances on Clay Surfaces: A Periodic Density Functional Theory Study
Timothy C Ricard, Glen R Jenness, Manoj K Shukla
Physical Chemistry Chemical Physics : PCCP
|
December 8, 2025
Exploring the initial bond activations of PFAS on zero-valent iron
Glen R Jenness, Elizabeth R Zengel, Manoj K Shukla
Chemosphere
|
August 30, 2024
Structural investigation of the complexation between vitamin B12 and per- and polyfluoroalkyl substances: Insights into degradation using density functional theory
Ashlyn M Koval, Glen R Jenness, Manoj K Shukla
The Journal of Chemical Physics
|
January 19, 2010
A second generation distributed point polarizable water model
Revati Kumar, Fang-Fang Wang, Glen R Jenness, et al.
Environmental Science. Processes & Impacts
|
September 27, 2022
Atomistic insights into the hydrodefluorination of PFAS using silylium catalysts
Glen R Jenness, Ashlyn M Koval, Brian D Etz, et al.
The Journal of Physical Chemistry. A
|
March 18, 2011
Evaluation of theoretical approaches for describing the interaction of water with linear acenes
Glen R Jenness, Ozan Karalti, W A Al-Saidi, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 15) with videos related to
Sort By:
Page
of 2
Langmuir : the ACS Journal of Surfaces and Colloids
|
December 22, 2021
Effect of Concrete Composition on the Thermodynamic Binding of Dopamine: A DFT Study
Glen R Jenness, Manoj K Shukla
Physical Chemistry Chemical Physics : PCCP
|
April 24, 2010
Benchmark calculations of water-acene interaction energies: Extrapolation to the water-graphene limit and assessment of dispersion-corrected DFT methods
Glen R Jenness, Ozan Karalti, Kenneth D Jordan
Physical Chemistry Chemical Physics : PCCP
|
July 4, 2018
DFT investigation on the adsorption of munition compounds on α-Fe<sub>2</sub>O<sub>3</sub>: similarity and differences with α-Al<sub>2</sub>O<sub>3</sub>
Glen R Jenness, Jennifer Seiter, Manoj K Shukla
Journal of Chemical Theory and Computation
|
October 29, 2020
Adventures in DFTB: Toward an Automatic Parameterization Scheme
Glen R Jenness, Caitlin G Bresnahan, Manoj K Shukla
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
February 17, 2026
Adsorption of Isolated and Hydrated Linear Per- and Polyfluoroalkyl Substances on Clay Surfaces: A Periodic Density Functional Theory Study
Timothy C Ricard, Glen R Jenness, Manoj K Shukla
Physical Chemistry Chemical Physics : PCCP
|
December 8, 2025
Exploring the initial bond activations of PFAS on zero-valent iron
Glen R Jenness, Elizabeth R Zengel, Manoj K Shukla
Chemosphere
|
August 30, 2024
Structural investigation of the complexation between vitamin B12 and per- and polyfluoroalkyl substances: Insights into degradation using density functional theory
Ashlyn M Koval, Glen R Jenness, Manoj K Shukla
The Journal of Chemical Physics
|
January 19, 2010
A second generation distributed point polarizable water model
Revati Kumar, Fang-Fang Wang, Glen R Jenness, et al.
Environmental Science. Processes & Impacts
|
September 27, 2022
Atomistic insights into the hydrodefluorination of PFAS using silylium catalysts
Glen R Jenness, Ashlyn M Koval, Brian D Etz, et al.
The Journal of Physical Chemistry. A
|
March 18, 2011
Evaluation of theoretical approaches for describing the interaction of water with linear acenes
Glen R Jenness, Ozan Karalti, W A Al-Saidi, et al.
Page
of 2