Scine::Sparrow
5.1.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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Directories | |
directory | Dftb |
directory | Nddo |
directory | RealTimeSpectroscopy |
directory | TimeDependent |
Files | |
file | DipoleMatrixCalculator.h [code] |
file | DipoleMomentCalculator.h [code] |
file | Exceptions.h [code] |
file | GenericMethodWrapper.cpp |
file | GenericMethodWrapper.h [code] |
file | MoldenFileGenerator.cpp |
file | MoldenFileGenerator.h [code] |
file | OrbitalSteeringCalculator.cpp |
file | OrbitalSteeringCalculator.h [code] |
file | OrbitalSteeringSettings.h [code] |
file | PostScfCorrections.cpp |
file | PostScfCorrections.h [code] |
file | Sto6gParameters.h [code] |