Scine::Sparrow  5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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DFTB3.cpp File Reference
#include "DFTB3.h"
#include "Sparrow/Implementations/Dftb/Utils/DFTBCommon.h"
#include "Sparrow/Implementations/Dftb/Utils/DensityGuess.h"
#include "Sparrow/Implementations/Dftb/Utils/Overlap.h"
#include "Sparrow/Implementations/Dftb/Utils/Repulsion.h"
#include "Sparrow/Implementations/Dftb/Utils/SecondOrderFock.h"
#include "Sparrow/Implementations/Dftb/Utils/ThirdOrderFock.h"
#include "Sparrow/Implementations/Dftb/Utils/ZeroOrderMatricesCalculator.h"
#include <Utils/Scf/LcaoUtils/LcaoUtils.h>
Include dependency graph for DFTB3.cpp:

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.