Qing Zhao

Publications

1. Stable Surfaces That Bind Too Tightly: Can Range-Separated Hybrids or DFT+U Improve Paradoxical Descriptions of Surface Chemistry? (2019)
2. Electronic Structure Origins of Surface-Dependent Growth in III–V Quantum Dots (2018)
3. Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U (2018)
4. Density functional theory for modelling large molecular adsorbate–surface interactions: a mini-review and worked example (2017)
5. Global and local curvature in density functional theory (2016)
6. Predicting the Stability of Fullerene Allotropes Throughout the Periodic Table (2016)
7. Direct Observation of Early-Stage Quantum Dot Growth Mechanisms with High-Temperature Ab Initio Molecular Dynamics (2016)
8. Discovering Amorphous Indium Phosphide Nanostructures with High-Temperature ab Initio Molecular Dynamics (2015)