tblite
Light-weight tight-binding framework
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Contains element data used for defining interactions.
More...Files | |
atomicrad.f90 | |
Provides atomic radii for all elements. | |
covrad.f90 | |
Provides covalent radii for all elements. | |
paulingen.f90 | |
Provides electronegativities for all elements. | |
spin.f90 | |
Provides spin constants for all elements. | |
Contains element data used for defining interactions.