Main Page

Welcome to the documentation of PEXSI (current version: v0.7.1)

• Introduction
  • Overview
  • License
  • References
  • Change Log
• Download
• Installation
  • Dependencies
  • Build PEXSI
• Tutorial
  • Using plans
  • Parallel selected inversion for a real symmetric matrix
  • Parallel selected inversion for a complex symmetric matrix
  • Solving Kohn-Sham density functional theory: I
  • Solving Kohn-Sham density functional theory: II
• Core Functionality
  • Basic
  • Data type
  • Pole expansion
  • Factorization
  • Selected Inversion
  • C/C++ interface
  • FORTRAN interface
• Frequently asked questions
• Troubleshooting