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dft:start [2016/10/10 09:40]
127.0.0.1 external edit
dft:start [2019/02/21 08:40] (current)
Maurits W. Haverkort
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-Quanty can be used as a post DFT or Hartree-Fock program. We however do not provide a fully optimized code to do the DFT or Hartree-Fock calculations. Instead we use on of the many implementations already available ​in link into these codes. Here we provide links to these codes and show how one can use these as input for our calculations.+Quanty can be used as a post DFT or Hartree-Fock program. We however do not provide a fully optimized code to do the DFT or Hartree-Fock calculations. Instead we use on of the many implementations already available ​and link into these codes. Here we provide links to these codes and show how one can use these as input for our calculations.
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