QECalc documentation

Contents:

• QECalc overview
• Quick Start
  • Installation
  • How to use
• Quick Tutorial
  • Organization
  • Configuration
  • Torque
  • Example 1: MultiPhononCalc
  • Example 2: Converger
  • Example 3: Loops
  • Example 4: Working with structures
• API
  • Class backbone of QECalc
  • QECalc
  • QETask
  • QEStructure
  • QEAtom
  • QEInput

Indices and tables

• Index
• Module Index
• Search Page