Qx80610702/DFT_plus_DMFT

Introduction

This is a standalone open-source package mainly writen by C++ for density functional theory plus dynamical mean field theory (DFT+DMFT) based on the framework of the linear combination of numerical atomic orbital (LCNAO). At present, the package supports the DFT+DMFT calculations through merging two LCNAO DFT codes - FHI-aims and ABACUS and three CT-HYB impurity solvers.

Table of contents

• Introduction
• Table of contents
• Compilation
• Quickstart guide
  • Input and output files
  • Hands-on examples
• Developer manual