Jeng‐Da Chai
National Taiwan University(TW)National Center for Theoretical Sciences(TW)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Spectroscopy and Quantum Chemical Studies, Graphene research and applications, Fullerene Chemistry and Applications, Machine Learning in Materials Science
Most-Cited Works
- → Systematic optimization of long-range corrected hybrid density functionals(2008)3,988 cited
- → Long-Range Corrected Hybrid Density Functionals with Improved Dispersion Corrections(2012)905 cited
- → Long-range corrected double-hybrid density functionals(2009)416 cited
- → SCAN-based hybrid and double-hybrid density functionals from models without fitted parameters(2016)191 cited
- → Density functional theory with fractional orbital occupations(2012)170 cited
- → Seeking for reliable double-hybrid density functionals without fitting parameters: The PBE0-2 functional(2012)151 cited
- → Impact of Metal and Anion Substitutions on the Hydrogen Storage Properties of M-BTT Metal–Organic Frameworks(2012)