MoldenFileGeneratorTest.cpp File Reference

#include <Core/ModuleManager.h>
#include <Sparrow/Implementations/MoldenFileGenerator.h>
#include <Sparrow/Implementations/Nddo/Pm6/Wrapper/PM6MethodWrapper.h>
#include <Utils/IO/ChemicalFileFormats/XyzStreamHandler.h>
#include <Utils/Scf/LcaoUtils/SpinMode.h>
#include <gmock/gmock.h>

Include dependency graph for MoldenFileGeneratorTest.cpp:

Classes
class	Scine::Sparrow::Tests::AMoldenFileGeneratorTest

Functions
	Scine::Sparrow::Tests::TEST_F (AMoldenFileGeneratorTest, CanGenerateGTOAtomAndMOsForWavefunctionH2O)
	Scine::Sparrow::Tests::TEST_F (AMoldenFileGeneratorTest, CanGenerateWavefunctionThroughInterfaceH2O)
	Scine::Sparrow::Tests::TEST_F (AMoldenFileGeneratorTest, CanGenerateMOsForWavefunctionFeO)
	Scine::Sparrow::Tests::TEST_F (AMoldenFileGeneratorTest, CanGenerateMOsForUnrestrictedWavefunctionFeO)
	Scine::Sparrow::Tests::TEST_F (AMoldenFileGeneratorTest, CanGenerateWavefunctionThroughInterfaceFeO)

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.