Questions Related to doped

[kavanase]

This MatSci forum is for questions related to doped and defect modelling.

Before taking developer time in dealing with questions, we kindly ask that you first check the following curated resources for answers, as many questions have been answered before:

• doped documentation site – tip: use the search bar on the left.
• doped tutorials
• doped Python API docs
• Previous doped issues where the same question may have been asked – tip: use the search bar.
• All other doped docs pages; such as Tips, Troubleshooting and Installation

If your question is about general defect calculation methodology (rather than specific to doped), please refer to the following papers, and other relevant literature:

• Guidelines for Defect Simulations – Squires et al.
• Quick-Start Guide on Defect Calculations – Kim et al.
• Large Review on Defect Calculations – Freysoldt et al.
• Defect Structure Searching – Mosquera-Lois et al.
• Free Energies of Defects – Mosquera-Lois et al.

Bug reports should go directly to the GitHub Issues page