Research Topics
First-principles density-functional calculations
- Microscopic understanding and prediction
- Band structure engineering
- Materials Genome: time/cost efficient
Ab-initio Molecular Dynamics
- Liquid quench simulations
Transparent oxide conductors and semiconductors
- Crystalline and amorphous phases
- Composition, defect formation, carrier transport
- Deposition-structure-property relationships
- Theory guidance for growth/characterization/performance
Advanced steels
- Alloying, fracture, deformation
Facilities
- High-performance supercomputer centers: XSEDE, NERSC
Keywords
- Density functional calculations, ab-initio molecular dynamics, transparent conducting oxides, amorphous semiconductors
Recognitions/Significant achievements
- 70+ publications, 1800+ citations, H-index 24, i10-index 38
- 2016 TMS-AIME Champion H. Mathewson Medal Award
- 2015 Gilbert R. Speich Award, AIST
- Book chapter in “Transparent Electronics: From Synthesis to Applications”, John Wiley & Sons; 2010
Funding