Main Data — Table

Cage compound Sc5Pt24B12: a Pt-stuffed variant of filled skutterudite structure. Electronic and structural properties

“…The crystal structure data were subsequently standardized with the program STRUCTURE TIDY. 37 The details of data collection and handling are summarized in Table 1; interatomic distances are listed in Table 2. As inferred from Rietveld refinement, powder XRD intensities collected from the three-phase alloy with nominal composition Sc 10 Pt 61 B 29 are in best agreement with the intensities calculated from the structural model taken from the single crystal (Fig.…”

Electronic and structural properties of Y6Pt13X4, site occupancy variants of the Ba6Na16N subnitride (X = Al, Ga)

“…aCrystal structure data are standardized using the program Structure Tidy. 54 bAnisotropic ( U ij ) atomic displacement parameters are given in Å 2 .…”