CADPAC

The Cambridge Analytic Derivatives Package

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Documentation is available in the online manual
  •  Chapter 1 - Introduction
  •  Chapter 2 - Calculating Energies at the SCF Level
  •  Chapter 3 - Calculating Energies at a Correlated Level
  •  Chapter 4 - Geometry Optimisations
  •  Chapter 5 - Force Constant Calculations
  •  Chapter 6 - Molecular Properties
  •  Chapter 7 - Density Functional Theory

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