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. 2020 Apr 3;142(17):7813–7826. doi: 10.1021/jacs.0c00647

Table 1. Activation Energies (Ea) for Halide Migration in Tin(II) Halide Perovskites and Related Phasesa.

material Ea (kJ/mol) Ea (eV) technique ref
MASnBr3 (4.7 T) 42.7 ± 0.5 0.44 solid–state NMR this work
MASnBr3 (9.4 T) 31.9 ± 0.1 0.33    
MASnBr3 (17.6 T) 34.1 ± 0.1 0.35    
MASnBr3 (average)b 36 ± 6 0.37 ± 0.06    
MASnBr3 29.1 0.30 ac conductivity (111)
MASnBr3 30 0.31 dc conductivity (112)
α-SnI2 28 0.29 ac conductivity (115)
MASnI3 63 0.37 (VI)c DFT (118)
    0.65 (Ii)c  
MAPbI3 28 ± 6 0.29 ± 0.06 transient ion-drift (116)
MAPbI3 16 0.17 127I NQR (57)
a

The uncertainty is given as one standard deviation.

b

The uncertainty is calculated as the standard error of the average.

c

Defect formation energy at the valence band maximum: VI, iodide vacancy; Ii, iodide interstitial.