tblite
Light-weight tight-binding framework
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Provides a collection for all Coulomb related interactions. More...
Data Types | |
type | tblite_xtb_coulomb::tb_coulomb |
Collection of Coulombic interactions. More... | |
Modules | |
module | tblite_xtb_coulomb |
Collects all Coulomb related interaction in as single interaction container. | |
Functions/Subroutines | |
subroutine | tblite_xtb_coulomb::update (self, mol, cache) |
Provides a collection for all Coulomb related interactions.