Placeholder for Hessian calculation
| Type | Intent | Optional | Attributes | Name | ||
|---|---|---|---|---|---|---|
| class(hf_method_t), | intent(in) | :: | this | |||
| type(physical_fragment_t), | intent(in) | :: | fragment | |||
| type(calculation_result_t), | intent(out) | :: | result |
subroutine null_hessian(this, fragment, result) !! Placeholder for Hessian calculation class(hf_method_t), intent(in) :: this type(physical_fragment_t), intent(in) :: fragment type(calculation_result_t), intent(out) :: result print *, "HF: Hessian calculation not implemented yet." result%has_hessian = .false. end subroutine null_hessian