Daniel King
Graduate Student
Term of Engagement: 2019 ->
Research Areas
Catalysis, Electronic Structure, Machine Learning, Metal Organic FrameworksEducation
- B.A. Chemistry and Physics, St. Olaf College (2019)
- MS University of Minnesota (2021)
Publications
- Variational Active Space Selection with Multiconfiguration Pair-Density Functional Theory
- Linearized Pair-Density Functional Theory for Vertical Excitation Energies
- Challenge of Small Energy Differences in Metal–Organic Framework Reactivity
- High-Throughput Experimentation, Theoretical Modeling, and Human Intuition: Lessons Learned in Metal–Organic-Framework-Supported Catalyst Design
- Large-Scale Benchmarking of Multireference Vertical-Excitation Calculations via Automated Active-Space Selection
Awards and Academic Achievements
- 3M Fellowship, 2019
- SCGSR Award 2021