tblite
Light-weight tight-binding framework
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Provides a cache specific for all Coulomb interactions. More...
Data Types | |
type | tblite_coulomb_cache::coulomb_cache |
Modules | |
module | tblite_coulomb_cache |
Data container for mutable data in electrostatic calculations. | |
Functions/Subroutines | |
subroutine | tblite_coulomb_cache::update (self, mol) |
Provides a cache specific for all Coulomb interactions.