Chapman, W.

Authored

(544i) Dynamic Molecular Modes to Interpret NMR Relaxation at High Frequencies: Theory and Applications
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(410h) Explicit Water Molecular Dynamics Is Indispensable for Validating Simulated Scattering Profiles of Polyampholytes Against SAXS
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(197bv) Molecular Insights from Simulations on MRI Contrast Agents in Different Chemical Environments
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(465b) A New Scientific Approach to Interpret NMR Relaxation Response Using Molecular Dynamics Simulations: A Molecular Probe of Material Properties and MRI Contrast Agents
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(129c) Bridging the Gap between Scattering Results from Simulations and Experiments for Polyampholytes
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(181c) Molecular Modes from NMR Relaxation in Fluids: Going Beyond the Bpp Theory
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(712a) Critical Evaluation of Implicit Solvent Hydration Free Energies from EEF1, Absinth, and GB/SA Versus Explicit Solvent Molecular-QCT Calculations
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(482b) Molecular Insights into NMR Relaxation of Gd(III)-Based Contrast Agents for MRI Applications
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(55a) Beyond Flory-Huggins: Activity Coefficients from Perturbation Theory for Polar, Polarizable, and Associating Molecules from Solvents to Polymers
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(181g) Molecular Modeling of Alcohol Effects in Nonionic Surfactant Micelles with Density Functional Theory
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(741d) Perturbation Theory Based Equations of State: Review and Applications
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(185c) Effect of Nano-Confinement on NMR Relaxation Using Atomistic Simulations
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(723b) The Necessity of Large System Size in Interpreting Solvent Effects on Hydration and Kinetics in Atomistic Simulation
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(252i) Phase Behavior and Percolation in Mixed Patchy Colloids
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(508f) Modeling of Lignin–Ethanol–Water Ternary Phase Behavior Using PC-SAFT
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(722f) Surface Tension Models for Industrial Applications
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(626c) Competitive Sorption of CO2 in Shale Nanopores for Sequestration and Enhanced Gas Recovery Using Molecular Density Functional Theory
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(174a) Cubic-Plus-Chain (CPC): A SAFT-Based Chain Modification to the Cubic Equation of State for Large Nonpolar Molecules
2020 Virtual Spring Meeting and 16th GCPS (ISBN: 978-0-8169-1113-4)
(63f) Theoretical Phase Diagram of Self-Assembled Patchy Particles: Fluid and Solid Phases
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(553g) Self-Assembly and Phase Behavior of Hyperbranched Copolymers
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(764b) Self-Assembly and Phase Behavior of Mixed Patchy Colloids with Any Bonding Site Geometry: Theory and Simulation
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(559m) NMR Relaxation and Diffusion in Model Organic Shale Using Molecular Simulations
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(698i) Predicting Contact Angle in Oil/Brine/Calcite Systems Using Molecular Simulations
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(50g) Modeling a Mixture of Multi-Bonding Site Solute and Patchy Colloidal Solvent in Confined Systems
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(189aj) Modeling Side Chain Conformations of Bottlebrush Polymers from iSAFT Density Functional Theory
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(367c) Electrostatic and Induction Effects in Solubility of Water in Alkane
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(189aw) Molecular Modeling of Microstructure and Solubilization of Single and Multiple Micelles
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(175j) A Thermodyanimc-Based Approach to Predict Solid-Liquid Interfacial Tension : Molecular Dynamics Simulation
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(189ck) Electrophilic Aromatic Substitution and Intrinsic Nature of Aromaticity
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(707c) Molecular Dynamics Simulations of NMR Relaxation: Concepts and Applications to Hydrocarbons and Water in Confined Systems
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(739e) NMR Relaxation from Molecular Simulations: Study on Bulk Hydrocarbons and Water
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(189cc) Prediction of Calcium Carbonate Wettability By Low Salinity Water Flooding Using Molecular Dynamics Simulations
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(95a) Molecular Design of Polymer and Colloid By a Novel Solution Method Using Interfacial Statistical Associating Fluid Theory (iSAFT)
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(189bu) Thermodynamic Modeling of Saturn Particles and Phase Behavior in Patchy Colloid Mixtures
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(195e) A Matlab Based Tool Package for Interfacial Property Calculations
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(260c) Modeling Alkane Partitioning and Phase Behavior on Graphite Pores: A Discussion on Dispersion Free Energy Formalism
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(669f) Measurement and Surface Complexation Modeling of Calcite Zeta Potential in Mixed Brines for Carbonate Wettability Characterization
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(749j) Molecular Modeling of Microstructure, Solubilization and Micro-Emulsion of Block Copolymer Micelles By iSAFT
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(140a) Adsorption and Phase Behavior of Mixed Alkanes in Nano Slit Graphite Pores: An iSAFT Application
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(192k) Modeling Alkane Partitioning and Phase Behavior in Non-Permeable and Permeable Slit Pores
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(83d) A Novel Density Gradient Theory for Surfactant Molecules – Applied to Oil/Water Interfaces
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(365e) Water Content of Natural Gas Systems in Equilibrium with an Aqueous or a Hydrate Phase – Experimental Measurements and Molecular Modeling
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(163e) Modeling Solute and Solvent Distributions in Functionalized Dendrimers from iSAFT Density Functional Theory
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
Modeling Alkane Partitioning and Phase Behavior in Non-Permeable and Permeable Slit Pores
9th Southwest Process Technology Conference
(141g) Associating Colloids and Active Surfaces; A Density Functional Theory Approach with Multi-Body Correlations
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(452e) Hydrophobic and Hydrophilic Interactions in Aqueous Mixtures of Alcohols At a Hydrophobic Surface
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(51e) Interfacial Tension Prediction of Water/Oil Mixtures Using Stabilized Density Gradient Theory and Using iSAFT Density Functional Theory
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(517e) Dynamic Stiffening of Liquid Crystal Elastomers
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(716f) Properties of Mixed Patchy Colloids: Improved Theory for Multi-Body Effects in the Reference Fluid
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(208e) A Molecular-Level Model for Predicting Properties of Electrolytes At High Pressure and Temperature
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)

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