Peter T. Cummings Citation name: Cummings, P. T. Affiliation: Vanderbilt University State: TN Country: USA Sessions chaired or co-chaired:Beyond Standard Hardware: GPUs, Cloud Computing and Crowdsourcing2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)Authored:(62g) Molecular Simulation of Metal-Ionic Liquid InterfacesMatt ThompsonPeter T. CummingsRobert SacciJennifer BlackNina Balke2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(220a) Slip Slidin' Away: Three Decades of Adventures in Computational Rheology and LubricationPeter T. CummingsClare McCabeChristoph KleinChristopher R. Iacovella2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(591a) Molecular Dynamics Simulation Study on Dicationic Ionic Liquid Electrolytes in SupercapacitorsSong LiGuang FengPeter T. Cummings2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(218i) Molecular Structure and Dynamics in Room Temperature Ionic Liquids – Insights from Molecular Experiment and SimulationPeter T. CummingsSong LiGuang Feng2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(253am) A Transferable Multi-Resolution Coarse-Grained Model for Amorphous Silica NanoparticlesAndrew Z. SummersChristopher R. IacovellaPeter T. CummingsClare McCabeOlivia M. Cane2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(757g) Molecular Dynamics Study on the Effects of Nanoscale Roughness on the Wear of Alkylsilane MonolayersAndrew Z. SummersChristopher R. IacovellaPeter T. CummingsClare McCabe2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(232u) Molecular Dynamics Study of the Capacitive Performance of Oxidized GrapheneYu ZhangBoris DyatkinC. Heath TurnerYury GogotsiPeter T. Cummings2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(253ay) A General Tool Chain for Screening of Soft MaterialsChristoph KleinJános SallaiTrevor J. JonesChristopher R. IacovellaClare McCabePeter T. Cummings2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(200e) Choline and Phosphoryl Contributions to Hydration Structure and Dynamics of Poly(2-methacryloyloxyethyl phosphorylcholine)Christoph KleinWilliam L. RoussellChristopher R. IacovellaClare McCabePeter T. Cummings2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(595e) Application of Concepts from Modeling Integrated Computing for Molecular Simulation for Workflow EncapsulationChristoph KleinChristopher R. IacovellaJános SallaiÁkos LédecziClare McCabePeter T. Cummings2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(253bd) A Logic-Based Framework for Defining Force Field Usage Semantics and Atom-Typing Molecular SystemsChristopher R. IacovellaChristoph KleinJános SallaiClare McCabePeter T. Cummings2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(536h) Microstructure of Room-Temperature Ionic Liquids at Charged Surfaces Revealed By Integrated Modeling and Experimental ApproachesGuang FengJennifer BlackNina BalkePeter T. Cummings2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)(1b) Mosdef: Molecular Simulation and Design FrameworkPeter T. CummingsChristoph KleinJános SallaiAndrew Z. SummersChristopher R. IacovellaÁkos LédecziClare McCabe2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(83b) Capacitance and Ion Dynamics of Ionic Liquids Near Oxidized GrapheneBoris DyatkinYu ZhangYury GogotsiPeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(140e) Alkyl Chain Length and Nanoconfinement Effects on Dynamics of Imidazolium-Based Ionic LiquidsYu ZhangNaresh C. OtsiEugene MamontovPeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(675g) Identifying Relationships between Terminal Group Chemistry and Interfacial Friction in Monolayer-Based Lubrication through a Molecular Dynamics Screening ApproachAndrew Z. SummersChristopher R. IacovellaPeter T. CummingsClare McCabe2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(736h) Foyer: A Framework for Defining Force Field Usage Semantics and Atom-Typing Molecular SystemsChristoph KleinJános SallaiAndrew Z. SummersPeter T. CummingsChristopher R. IacovellaClare McCabe2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(736f) Mosdef: Molecular Simulation and Design FrameworkChristoph KleinJános SallaiAndrew Z. SummersChristopher R. IacovellaÁkos LédecziClare McCabePeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(192bg) Mosdef, a Python-Based Molecular Simulation and Design FrameworkJustin GilmerChristoph KleinJános SallaiAndrew Z. SummersChristopher R. IacovellaÁkos LédecziClare McCabePeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(192bh) Screening Self-Assembled Monolayers for Lubrication Properties: Trends and PitfallsChristoph KleinTrevor J. JonesChristopher R. IacovellaClare McCabePeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(163c) Hydration Structure and Dynamics of Poly(2-methacryloyloxyethyl phosphorylcholine)Christoph KleinWilliam L. RoussellChristopher R. IacovellaClare McCabePeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(192q) Molecular Simulation of Ionic Liquid Mixtures: Applications to Capacitive Energy StorageMatt ThompsonKatherine L. Van AkenRobert SacciJustin NealJianzhong WuYury GogotsiPeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(192r) Molecular Simulation of Ionic Liquid Systems: Effects of Solvation and HumidificationMatt ThompsonFelix TietNaresh C. OtsiBoris DyatkinKatherine L. Van AkenDe-en JiangYury GogotsiEugene MamontovPeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(614c) Molecular Studies of Supercapacitors: Ionic Liquids Adsorbed into Porous Carbon ElectrodesPeter T. Cummings2017 Annual Meeting (ISBN: 978-0-8169-1102-8)(309g) Dynamic and Structural Properties of Room Temperature Ionic Liquids Near Silica and Carbon SurfacesSong LiGuang FengKee Sung HanEdward HagamanLukas VlcekPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(742e) Molecular Dynamics Study On the Capacitive Performance of Double-Cationic Ionic Liquid ElectrolytesSong LiGuang FengPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(311c) Distinctive Nanoscale Organization of Double- Cationic Versus Single-Cationic Ionic LiquidsSong LiGuang FengJose Leo BanuelosGernot RotherPasquale F. FulvioSheng DaiPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(682f) Energy Storage Mechanism of Porous SupercapacitorsGuang FengRui QiaoPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(309h) Electrical Double Layers in Double-Cationic Ionic LiquidsGuang FengSong LiPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(773a) Investigating Structurally Realistic Molecular Transport Junctions Via Atomistic Simulations and Conductance CalculationsWilliam R. FrenchChristopher R. IacovellaPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(384g) Metadynamics Simulations of Dissolution of Minerals. Overcoming Hidden Energy Barriers ProblemStepan HlushakPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(329g) Study of Phase Transitions By 2-D Density of States SimulationLili GaiChristopher R. IacovellaPeter T. CummingsClare McCabe2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(363e) Surface Corrugation Effects On the Behavior of Water Under Extreme Graphene ConfinementAriel A. ChialvoLukas VlcekPeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(303g) Reactive Molecular Dynamics Study of Alkylsilane Monolayers On Realistic Amorphous Silica SubstratesJana E. BlackChristopher R. IacovellaClare McCabePeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(148g) Calculation of the Vapor-Liquid Phase Coexistence of Polymer-Grafted NanoparticlesSiladitya MukherjeeJessica D. HaleyChristopher R. IacovellaClare McCabePeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(629f) An Improved Classical Density Functional Theory for the Description of Adsorption ThermodynamicsStepan HlushakClare McCabePeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(173c) Water Flow in Nano Channels of Quartz, Titanium Dioxide and Carbon NanotubesMing-Jie WeiClare McCabePeter T. Cummings2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)(227c) My Research Adventures with Pete MonsonPeter T. Cummings2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(709f) Solvation of Ionic Liquids on Supercapacitor’s Performance: Insights from Molecular Dynamics SimulationYu ZhangPeter T. Cummings2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(13f) Screening Structure-Property Relationships in Lubricating Monolayer Films through Molecular Dynamics SimulationAndrew Z. SummersChristopher R. IacovellaClare McCabePeter T. Cummings2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(13a) Understanding Confinement Effects in Mixed Ionic Liquid Systems: Insights from Molecular Dynamics SimulationsMatt ThompsonPeter T. CummingsYury GogotsiKatherine L. Van Aken2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(462d) Investigating Diffusivity of Solvated Ionic Liquids through Molecular Dynamics ScreeningMatt ThompsonRay MatsumotoPeter T. Cummings2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(189ar) Comparison of Interatomic Potentials for Interfacial Studies of Ionic Liquid SystemsFelix TietMatt ThompsonPeter T. Cummings2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(189at) Foyer: A Framework for Defining Force Field Usage Semantics and Atom-Typing Molecular SystemsChristopher R. IacovellaChristoph KleinJustin GilmerAndrew Z. SummersJana E. BlackJános SallaiPeter VolgyesiClare McCabePeter T. Cummings2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(189au) MoSDeF: A Python-Based Molecular Simulation and Design FrameworkJustin GilmerChristoph KleinJános SallaiAndrew Z. SummersChris IacovellaÁkos LédecziPeter VolgyesiPeter T. CummingsClare McCabe2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(710i) MoSDeF: Molecular Simulation and Design Framework for Transparent, Reproducible, Usable By Others, Extensible Simulations (TRUE)Peter T. CummingsJustin GilmerChristoph KleinJános SallaiAndrew Z. SummersChris IacovellaÁkos LédecziPeter VolgyesiClare McCabe2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(648h) Zwitterionic Contribution to the Hydration Lubrication Dynamics of Poly(2-methacryloyloxyethyl phosphorylcholine)Justin GilmerChristoph KleinWilliam L. RoussellChris IacovellaPeter T. CummingsClare McCabe2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(1a) MoSDeF: Molecular Simulation and Design FrameworkPeter T. Cummings2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)(643d) Investigation of Ion Correlations in Ionic Liquid and Organic Solvent Mixtures through Scalable ScreeningRay MatsumotoMatt ThompsonPeter T. Cummings2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)(376am) Foyer: A Framework for Defining Force Field Usage Semantics and Atom-Typing Molecular SystemsChristopher R. IacovellaJustin GilmerChristoph KleinAndrew Z. SummersMatt ThompsonPeter T. CummingsClare McCabeJános SallaiPeter Volgyesi2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)(729c) Molecular Simulation and Design Framework (MoSDef) for Transparent, Reproducible, Usable By Others, Extensible Simulations (TRUE)Peter T. CummingsJustin GilmerChristoph KleinMatt ThompsonJános SallaiAndrew Z. SummersChristopher R. IacovellaÁkos LédecziPeter VolgyesiClare McCabe2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)(698g) Examination of the Relationships between Terminal Group Chemistry and Tribological Properties in Monolayer Films through Molecular Dynamics ScreeningAndrew Z. SummersJustin GilmerChristopher R. IacovellaPeter T. CummingsClare McCabe2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)(376ar) Mosdef: A Python-Based Molecular Simulation and Design FrameworkJustin GilmerChristoph KleinMatthew W. ThompsonAndrew Z. SummersJános SallaiChristopher R. IacovellaÁkos LédecziPeter VolgyesiPeter T. CummingsClare McCabe2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)(161j) Accelerating Large-Scale Screening of Tribological Properties and ChemistriesJustin GilmerAndrew Z. SummersChristopher R. IacovellaPeter T. CummingsClare McCabe2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)(225i) Van Hove Correlations in Aqueous Systems: Insights from Molecular SimulationPeter T. CummingsMatt ThompsonRay Matsumoto2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)(571d) CACHE Initiatives: Molecular ModelingPeter T. Cummings2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)