Ionisation of atoms determined by kappa refinement against 3D electron diffraction data
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DOI: 10.1038/s41467-024-53448-2
Abstract: Conventional refinement strategies used for three-dimensional electron diffraction (3D ED) data disregard the bonding effects between the atoms in a molecule by assuming a pure spherical model called the Independent Atom model (IAM) and may… read more here.
Keywords: diffraction data; refinement; kappa refinement; electron diffraction ... See more keywords