Scine::Sparrow  5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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Classes | Enumerations
MultipoleChargePair.h File Reference
#include "MultipoleCharge.h"
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Classes

class  Scine::Sparrow::nddo::multipole::MultipoleChargePair
 

Enumerations

enum  ChargeDistanceSeparation {
  d00, d01, d10, d02,
  d20, d0s2, ds20, p11,
  m11, p12, p21, m12,
  m21, p1s2, ps21, m1s2,
  ms21, p22, m22, p2s2,
  ps22, m2s2, ms22, ps2s2,
  ms2s2
}
 

Detailed Description

Copyright
This code is licensed under the 3-clause BSD license.
Copyright ETH Zurich, Department of Chemistry and Applied Biosciences, Reiher Group.
See LICENSE.txt for details.