Adri van Duin

Presentation History

2024 MRS Fall Meeting & Exhibit

Star-Shaped WS₂ Monolayers with Twin Grain Boundaries Promoted by Molybdenum Doping

Dec 3, 2024, 4:30 PM

2024 MRS Fall Meeting & Exhibit

Theory Insights into the Synthesis of 2D Materials—2D Metals, Single-Crystal TMD Monolayers, Frustrated Salts and Disclinated Graphene

Dec 3, 2024, 10:15 AM

2024 MRS Fall Meeting & Exhibit

Scalable Integration of Crystalline Oxide Dielectrics with 2D Semiconductors Through Epitaxial Metal Deposition and Controlled Oxidation

Dec 1, 2024, 11:15 AM

2024 MRS Spring Meeting & Exhibit

Star-Shaped WS₂ Monolayers with Twin Grain Boundaries Promoted by Molybdenum Atoms

Apr 24, 2024, 5:00 PM

2023 MRS Fall Meeting & Exhibit

Breaking Down the Building Blocks: Multi-Scale Model of Diels-Alder Reactions for Future Self-Healing and Recyclable Polymer Networks

Nov 27, 2023, 2:15 PM

2023 MRS Spring Meeting & Exhibit

Atomistic-Scale Simulations of Realistic, Complex, Reactive Materials—The ReaxFF Method, its Applications and Recent Developments

Apr 11, 2023, 3:00 PM

2022 MRS Spring Meeting

In Situ TEM Approaches to Study Dynamic Transformations in MXenes

May 10, 2022, 9:30 AM

2021 MRS Fall Meeting

A New Computational Framework for Structural Characterization and Edge-Growth Kinetics of Transition Metal Dichalcogenides—Reaxff Reactive Force Field

Dec 6, 2021, 8:00 AM

2021 MRS Fall Meeting

Thermal Decomposition of Titanium(IV) Isopropoxide Studied by Reactive Force-Field Molecular Dynamic Simulations

Nov 30, 2021, 2:00 PM

2021 MRS Spring Meeting

Understanding the Nuclear Quantum Effects on Proton Transfer in Ti₃C₂T₂ MXene with Co-Cation (Li⁺, Na⁺, K⁺) Intercalation Using ReaxFF Path-Integral Molecular Dynamics

Apr 14, 2021, 10:30 AM

2019 MRS Fall Meeting

Machine Learning Assisted Hybrid Reactive Molecular Dynamics Simulations

Dec 5, 2019, 4:45 PM

2019 MRS Fall Meeting

Computational Study on the Dielectric Strength of the Crosslinked Polyethylene Using e-ReaxFF Reactive Force Field

Dec 5, 2019, 4:30 PM

2019 MRS Fall Meeting

An Initial Design-Based Deep Learning Framework for ReaxFF Force Field Training

Dec 5, 2019, 4:00 PM

2019 MRS Fall Meeting

Computationally Guided Synthesis of Mesoporous Siliceous Materials Using Accelerated Reactive/Non-Reactive Molecular Dynamics Simulations

Dec 3, 2019, 8:00 PM

2019 MRS Fall Meeting

Classifying and Predicting the Electron Affinity of Hydrocarbons Using Machine Learning

Dec 2, 2019, 8:00 PM

2018 MRS Spring Meeting

In Situ Observation of Homoepitaxial Growth in MXene Ti₃C₂

Apr 3, 2018, 11:15 AM