Mathew Halls

Presentation History

2024 MRS Fall Meeting & Exhibit

Prediction of Aqueous and Non-Aqueous Solubility Using Machine Learning

Dec 5, 2024, 11:15 AM

2024 MRS Fall Meeting & Exhibit

Discovering Low-Viscosity Molecules Using an Integrated Physics-Based Modeling, High-Throughput Screening and Active Learning Approach (1)— Screening from the GDB Database

Dec 4, 2024, 3:45 PM

2024 MRS Fall Meeting & Exhibit

Discovering Low-Viscosity Molecules Using an Integrated Physics-Based Modeling, High-Throughput Screening, and Active Learning Approach (2)— Screening from PubChem Database

Dec 3, 2024, 8:00 PM

2024 MRS Spring Meeting & Exhibit

Development of Next-Generation OPLS Force Field for Accurate Modeling of Phosphorescent OLED Materials

Apr 25, 2024, 5:00 PM

2023 MRS Fall Meeting & Exhibit

Predicting Solvent-Dependent Optical Properties of Organic Molecules using Machine Learning with Physics-Based Descriptors

Nov 30, 2023, 10:00 AM

2023 MRS Fall Meeting & Exhibit

De Novo Design of Molecules with Low Viscosity (2): Multi-Property Optimization using the REINVENT Method

Nov 30, 2023, 9:45 AM

2023 MRS Fall Meeting & Exhibit

De Novo Design of Molecules with Low Viscosity (1): MD Calculations and the Design by Applying the REINVENT Method

Nov 30, 2023, 9:30 AM

2023 MRS Fall Meeting & Exhibit

Polymer Design Across Industries: Intersection of Physics-Based Simulation and Machine Learning

Nov 28, 2023, 3:15 PM

2023 MRS Fall Meeting & Exhibit

De Novo Design Methods Benchmark of GAN and Flow Models for Minimizing Hole Reorganization Energy

Nov 27, 2023, 2:15 PM

2023 MRS Spring Meeting & Exhibit

Predicting Small-Molecule Viscosities Using Machine Learning and Physics-Informed Approaches

Apr 14, 2023, 9:15 AM

2023 MRS Spring Meeting & Exhibit

Scalable and Generalizable Neural Network Potential for Polymers: Application to Ethylene Glycol and its Oligomers

Apr 12, 2023, 11:30 AM

2023 MRS Spring Meeting & Exhibit

Application of Machine-Learned Potentials to Accurately Model Polymer Materials

Apr 12, 2023, 11:15 AM

2022 MRS Fall Meeting

Combining Organic and Inorganic Descriptors for Predictions of Volatility Across Vast Chemical Space

Nov 29, 2022, 8:30 AM

2022 MRS Fall Meeting

High-Dimensional Neural Network Potential for Liquid Electrolyte Simulations

Nov 27, 2022, 11:30 AM

2022 MRS Spring Meeting

Prediction of Birefringence for Optical Polymer Materials

May 24, 2022, 10:00 PM

2022 MRS Spring Meeting

Design and Discovery of Novel OLED Materials via Active Learning

May 23, 2022, 12:00 PM

2021 MRS Fall Meeting

Rapid and Accurate Prediction of the Volatility of Organometallic Precursor Complexes

Dec 6, 2021, 7:30 PM

2021 MRS Spring Meeting

Late News: Efficient and Accurate Modeling of Thermoset Systems Using a Synergistic Combination of First-Principles Quantum Chemistry and Molecular Dynamics

Apr 23, 2021, 5:30 PM

2021 MRS Spring Meeting

Late News: Machine Learning Prediction of the Hubbard U for Materials Containing Transition Metals

Apr 20, 2021, 12:40 PM

2021 MRS Spring Meeting

Late News: Optoelectronics of Disordered Solid-State Morphologies—Advances in Atomic-Scale Simulations Towards Design of High-Performance OLEDs

Apr 18, 2021, 9:33 AM