Lj. Allen et al., OBTAINING THE CRYSTAL-POTENTIAL BY INVERSION FROM ELECTRON-SCATTERINGINTENSITIES, Acta crystallographica. Section A, Foundations of crystallography, 54, 1998, pp. 388-398
A method to obtain the crystal potential from the intensities of the d
iffracted beams in high-energy electron diffraction is proposed. It is
based on a series of measurements for specific well determined orient
ations of the incident beam, which determine the moduli of all element
s of the scattering matrix. Using unitarity and the specific form of t
he scattering matrix (including symmetries), an overdetermined set of
non-linear equations is obtained from these data. Solution of these eq
uations yields the required phase information and allows the determina
tion of a (projected) crystal potential by inversion that is unique up
to an arbitrary shift of the origin. The reconstruction of potentials
from intensities is illustrated for two realistic examples, a {111} s
ystematic row case in ZnS and a [110] zone-axis orientation in GaAs (b
oth noncentrosymmetric crystals).