CamCASP/ToDo

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Revision as of 12:56, 4 November 2008 by import>Am592 (→‎CamCASP -- To Do)
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CamCASP => To-Do list

CamCASP -- To Do

  1. Set up patch system for handling updates.
  1. Make tests automatic using James' test code.
  1. Take examples of energy scans etc. I have on my iLiad and put them here on the Wiki (and, eventually, in the User's Guide.
  1. Calculate perturbation matrix - currently in polarizability.f90 - in integrals.f90. At present it still uses Cartesian GTOs.