tblite
Light-weight tight-binding framework
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Provides a model for the anisotropic second-order electrostatic. More...
Data Types | |
type | tblite_param_multipole::multipole_record |
Representation of the multipolar electrostatics. More... | |
type | tblite_param_multipole::multipole_mask |
Masking for the anisotropic electrostatic parametrization. More... | |
interface | tblite_param_multipole::count |
Modules | |
module | tblite_param_multipole |
Definition of the anisotropic second-order electrostatic contributions. | |
Provides a model for the anisotropic second-order electrostatic.