lamaGOET

lamaGOET offers a friendly graphical interface that allows Hirshfeld Atom Refinement (HAR) and X-ray Constrained Wavefunction (XCW) fitting through Tonto. lamaGOET also allows the interface with dedicated quantum-chemical software (like Gaussian, Orca and the specialized ELMOdb program) with the refinement capabilities of Tonto to perform HAR.