Fig. 1: Structural properties and enthalpies of TeN6 under high pressures.
From: Formation mechanism of insensitive tellurium hexanitride with armchair-like cyclo-N6 anions
a Stable structures of the anti-CdCl2 phase at 120 GPa. b Planar cyclo-N6 sub-lattice interacted with Te atoms to form armchair-like N6 anions. c N–N bond lengths and Bader charge transfer as a function of pressure in TeN6. d Enthalpy of the anti-CdCl2 phase relative to the mixture of P3121-Te, TeN or TeN3 and the P41212 nitrogen phases.
