tblite
Light-weight tight-binding framework
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slater.f90 File Reference

Provides coefficients for contracted Gaussian type orbitals to approximate Slater type orbitals. More...

Data Types

interface  tblite_basis_slater::slater_to_gauss
 

Modules

module  tblite_basis_slater
 Implements expansion of Slater functions to contracted Gaussian functions.
 

Detailed Description

Provides coefficients for contracted Gaussian type orbitals to approximate Slater type orbitals.