Developing Algorithms and Computational Frameworks for Large-Scale Ab-Initio Calculations to Understand Materials Properties; Hpc Aspects of Electronic Structure Calculations; Electronic Structure Studies on Defects in Solids; Multi-Scale Modeling; Analysis of Approximation Theories

1 faculty research Developing Algorithms and Computational Frameworks for Large-Scale Ab-Initio Calculations to Understand Materials Properties; Hpc Aspects of Electronic Structure Calculations; Electronic Structure Studies on Defects in Solids; Multi-Scale Modeling; Analysis of Approximation Theories on GradNova.