Filip_Rivic_Optical Spectroscopy, Dielectric Properties and Structure Discrimination of SnN (20 ≤ N ≤ 40)_Figure1

Filip_Rivic_Optical Spectroscopy, Dielectric Properties and Structure Discrimination of SnN (20 ≤ N ≤ 40)_Figure1

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Figure 1: Schematic display of the prolate cluster growth to a quasi spherical structure for the predicted ground state structures (GM) for SnN with N = 20; 25; 30 and 40 at the PBE0/def2-TZVPP level of theory. Tin atoms are displayed as gray spheres and the two building blocks are highlighted in red (double-capped square antiprism) and yellow (triple-capped trigonal prism).