Frank Abild-Pedersen
Citation name
Abild-Pedersen, F.
Affiliation
SLAC National Accelerator Laboratory
State
CA
Country
USA
Authored
(38f) Assessing the Reliability of Calculated Catalytic Ammonia Synthesis Rates with Beef-Vdw
2014 AIChE Annual Meeting (ISBN: 978-0-8169-1086-1)
(700c) Effects of d-Band Shape on the Surface Reactivity of Transition-Metal Alloys
2014 AIChE Annual Meeting (ISBN: 978-0-8169-1086-1)
(382b) Role of Adsorbate-Adsorbate Interactions in Dynamics of Surface Bond Breaking
2014 AIChE Annual Meeting (ISBN: 978-0-8169-1086-1)
(573a) Understanding Trends in C-H Bond Activation in Heterogeneous Catalysis
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(617ct) Theoretical Study on Oxidative Coupling of Methane Using MgO
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(762d) Theoretical Investigation of Supported Utra-Thin Bilayer, Double Bilayer and Trilayer Metal-Oxides: Structure, Stabilty and Catalytic Activity
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(684a) A Simple Coordination-Based Model for Bimetallic Nanoparticles
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(661d) Sintering and Deactivation Mechanism of Platinum/Palladium Two-Phase Catalysts
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(734b) Activity and Thermal Stability in Well-Defined Platinum/Palladium Bimetallic Catalysts for Hydrocarbon Combustion
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(743a) Exploring Ruthenium Metal-Support Dynamics for the Low-Temperature Partial Oxidation of Methane
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(558g) Discovering Materials With Ultra-Low Work Functions for Thermionics Energy Conversion
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(472a) Methanol Synthesis From CO2 - Experiment and Theory
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(722e) Theoretical Analysis of Formic Acid Decomposition On Transition-Metal Catalysts
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(545a) Effects of Self-Compression On Metal Clusters
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(345b) Support Interactions in MoS2 for Hydrogen Evolution
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(699b) Predicting Adsorption Properties on Bimetallic Alloys As a Function of Local Morphology and Atomic Composition
2018 AIChE Annual Meeting (ISBN: 978-0-8169-1108-0)
(762b) Density-Dependent Deactivation Mechanism in Supported Catalysts By High-Temperature Decomposition of Particles into Single Atoms
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(93b) Integrating the Identification of Active-Site Ensembles within Descriptor-Based Screening Protocols for Bimetallic Catalysts
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(689g) On the Bottom-up Design of Bimetallic Catalytic Nanoparticles with Atomic Level Resolution
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(726h) Mechanistic Insights into Electrochemical CO(2) Reduction on Copper and Copper-Based Bimetallic Catalysts
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(363a) Understanding the Activity and Selectivity of Methanol Production from CO2
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(755h) Systematic Identification of Active Site for Propene Combustion Using Pd and Pt Bimetallic Nanocrystal Catalysts
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(599b) Including Catalyst Stabilities and Dynamics into Screening Protocols: Site-Specific Volcanos for NO Dissociation
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(187e) Unraveling Selectivity Toward Multi-Carbon Products for Electrochemical CO(2) Reduction
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(45d) Trends in Catalyst Stability and Reactivity: Extracting Physical Insights Using Simple Data-Driven Approaches
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(756f) Design of Bimetallic Catalysts for Alkane Selective Dehydrogenation
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(586g) Catalyst Changes at the Atomic Level Studied Using Nanocrystal Catalysts
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(513dx) Insights from Ultrafast Optical Pump - X-Ray Probe Studies of Adsorbate Excitation
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(631e) Systematic Identification of Active Site for Propene Combustion Using Pd/Pt Bimetallic Nanoparticle Catalysts and Theoretical Insights
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(582h) Elucidating Effect of Support Acidity Using Platinum Nanoparticles on Propane Combustion
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(124d) The Role of Surface Roughening in Improving the Selectivity of Copper for CO2 Electroreduction
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(509ao) Photo-Durability and Activity within the Ni-Sb-O system for Oxygen Evolution Reaction
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(387d) Site-Resolved Rates in Heterogeneous Catalysis Exemplified By NO Decomposition
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(265e) Elucidating How Nanoparticle Stability Metrics Depend on the Choice of Exchange Correlation Functionals Using Analytical Frameworks
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(411g) Predicting Site-Specific Reactivity from Local Surface Properties
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(509dd) Physics Based Machine Learning Modeling of O and OH Adsorption on Oxide Surfaces
2021 Annual Meeting (ISBN: 978-0-8169-1116-5)
(709g) Elucidating the Dependence of Nanoparticle Stability & Reactivity Metrics on the Choice of Exchange Correlation Functionals Using a Data Driven Approach
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(682a) The Influence of Atomic-Scale Active Site Distributions on Selectivity in Electroreduction of CO2
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(360y) The Nuclear and Surface Electrostatic Potential As Descriptors of Chemical Interactions
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(532aq) On the Character of the Fe Active Site in Fe-Doped NiOOH Catalysts during Oxygen Evolution Reaction
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(426d) Discovery of Pt Trimetallic Electrocatalysts for Ammonia Oxidation with Interpretable Deep Learning
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(682g) Mechanistic Insights Towards Selective C3 Product Formation in CO(2)r on Copper
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(710g) Elucidating the Role of Oxygen and Hydrogen in the Early Elementary Steps of Nitrate Reduction
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(426f) An Electronic Descriptor Based Machine Learned Model for Adsorption Energies on Oxide Materials
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(651e) Benchmarking Solvation Effects for Electroreduction of CO over Cu-Based Catalysts
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(477f) Integrating Experimental and Theoretical Data for High Quality Predictions of Electrocatalytic Performance
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(41a) A Theoretical Framework for Rapid Screening of Novel Multi-Metallic Alloy Catalysts
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(684d) Towards Swift Predictions of Metal Ad-Atom Diffusion Barriers and Surface Energies for Enhanced Understanding of Sintering and Catalysts Durability
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(684e) Developing a Theoretical Model to Unravel the Importance of Adsorbate Effects in Chemisorption on Surface Alloys
2022 Annual Meeting (ISBN: 978-0-8169-1118-9)
(646e) Computational Investigation into Supported and Inverted Cu-ZrO2 Catalysts for Selective Conversion of CO2 to Methanol
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(668f) Interfacial Engineering of Au/CuxOyHz Heterostructures for Efficient Photocatalytic CO2 Reduction: Insights from Theoretical Approaches
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(677h) Classification of Adsorbed Hydrocarbons Based on Surface Site Stabilities
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(650b) First Principles Study of Copper Cathodic Corrosion during CO2rr
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(197aj) Exploring the Factors behind Adsorbate-Adsorbate Interactions
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(697e) First-Principles Design of Nitrogen Reduction Catalysts: Taking Inspiration from Nature
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(521dx) Exploring Activity Descriptors in Electrocatalysis of Transition Metal-Oxides Using Computational Tools
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(664f) The Role of Surface Roughening in Improving the Selectivity of Copper for CO2 Electroreduction
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(696d) Design of Active Sites in Bimetallic NO Decomposition Catalysis
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(697f) Modeling Acidic Nitrate Reduction on Early Transition Metal Surfaces
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(669c) An Alternative Electrode Model for Understanding Reductive Microenvironments
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(667f) An Ab-Initio Molecular Dynamics Study of the Metal-Water Interface for ORR Activity in Alkaline Media.
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(696a) Predicting Metal Dynamics, Surface, and Segregation Energies in High Entropy Alloys for Sintering and Catalyst Durability
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(521ed) Towards Predicting Metal Dynamics, Surface, and Segregation Energies in High Entropy Alloys for Sintering and Catalyst Durability
2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)
(51a) In-Situ X-Ray Absorption Spectroscopy of Titanium/Titanium Hydride Electrode Evolution Under Electrochemical Nitrate Reduction Reaction Conditions
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(399e) Structure of the Electric Double Layer during Nitrate Reduction
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(7f) Unveiling the Mechanisms Underpinning Highly Active and Stable Emissions Control Catalysts
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(10g) Modeling Aqueous Hydroxide Ions As a Guide for CO2 Electrocatalytic Reduction
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(509f) Computational Investigation into Supported and Inverted Cu/ZrO2 Catalysts for Selective Conversion of CO2 to Methanol
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(569ct) Mechanistic Investigation into Dendrite Growth on Zinc Batteries
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(391d) Engineering the Cu-ZnO Interface By Atomic Layer Deposition for CO2 Hydrogenation to Methanol
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(509g) Mechanistic Understanding of Inverse ZrO2/Cu Catalysts for CO2 Hydrogenation to Methanol
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(363a) Advancing CO2 Reduction Modeling: A Comprehensive Tool for Electrolyte Effect Integration
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
(4gh) Unraveling Electrochemical Interfaces: From Fundamental Understanding to Practical Applications
2024 AIChE Annual Meeting (ISBN: 978-0-8169-1122-6)
Associated proceedings
2014 AIChE Annual Meeting
2016 AIChE Annual Meeting
2017 Annual Meeting
2013 AIChE Annual Meeting
2018 AIChE Annual Meeting
2019 AIChE Annual Meeting
2020 Virtual AIChE Annual Meeting
2021 Annual Meeting
2022 Annual Meeting
2023 AIChE Annual Meeting
2024 AIChE Annual Meeting