guess.f90 File Reference

Provides guesses for the wavefunction. More...

Data Types
interface	tblite_wavefunction_guess::sad_guess
interface	tblite_wavefunction_guess::eeq_guess

Modules
module	tblite_wavefunction_guess
	Implementation of the guess wavefunctions.

Functions/Subroutines
subroutine, public	tblite_wavefunction_guess::shell_partition (mol, calc, wfn)

Detailed Description

Provides guesses for the wavefunction.