Popular repositories Loading

1. VASP-DFT-Tutorial VASP-DFT-Tutorial Public

   General outline of how to perform DFT calculation using VASP with some advanced calculation topics as well

   16 6

2. VASP_scripts VASP_scripts Public

   A collection of scripts to help parse data from VASP inputs/outputs

   Python 2

3. Density-functional-U-modeling-of-polarons-in-organohalide-lead-perovskites Density-functional-U-modeling-of-polarons-in-organohalide-lead-perovskites Public

   Data for AIP Advances 6, 125037 (2016); doi: 10.1063/1.4972341

4. CsPbBr3-CuI-Interfaces CsPbBr3-CuI-Interfaces Public

   DFT studies of band offsets as a function of material thickness for CsPbBr3 and CuI

5. Python-programming Python-programming Public

   Jupyter Notebook

6. GaN-Diamond GaN-Diamond Public

   Modeling tools for GaN-DIamond simulations

   Jupyter Notebook