Thermal and structural properties, and molecular dynamics in organic–inorganic hybrid perovskite (C2H5NH3)2ZnCl4

Abstract

The thermal and structural properties and molecular dynamics of layered perovskite-type (C₂H₅NH₃)₂ZnCl₄ are investigated by differential scanning calorimetry, thermogravimetric analysis, and magic angle spinning nuclear magnetic resonance spectroscopy. The thermal properties and phase transitions are studied. Additionally, the Bloembergen–Purcell–Pound (BPP) curves for the ¹H spin–lattice relaxation time T_1ρ in the C₂H₅NH₃ cation and for the ¹³C T_1ρ in C₂H₅ are shown to have minima as a function of inverse temperature. This observation implies that these curves represent the rotational motions of ¹H and ¹³C in the C₂H₅NH₃ cation. The activation energies for ¹H and ¹³C in the C₂H₅NH₃ cation are obtained; the molecular motion of ¹H is enhanced at the C-end and N-end of the organic cation, and that at the carbons of the main chain is not as free as that for protons at the C-end and N-end.