dfttk

Contents:

  • Installation
  • API
    • Input Preparation
      • dfttk.vasp_input
    • Running Calculations
    • Post-processing
    • Configuration
    • Utilities
dfttk
  • API
  • Input Preparation
  • Edit on GitHub

Input Preparation

  • dfttk.vasp_input
    • base_set()
    • volume_relax_set()
    • conv_set()
    • ev_curve_set()
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