The LEED packages are designed for surface structure determination from experimental LEED IV curves. They are primarily used with ordered, commensurate surface structures. They can also be applied unchanged to adsorbate systems with lattice-gas disorder (and some incommensurate structures), by simulating diffuse LEED. No spin polarization is included. Relativistic effects are only included through (spin-averaged) relativistic phase shifts.
Keywords for this software
References in zbMATH (referenced in 1 article )
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- Blum, V.; Heinz, K.: Fast LEED intensity calculations for surface crystallography using tensor LEED (2001)