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. 2020 Nov 5;5(45):29081–29091. doi: 10.1021/acsomega.0c03685

Table 1. Calculated Enthalpy of Formation Per Formula Unit of Bi2WO6 and the Possible Limiting Phases by HSE06 Calculationa.

compound ΔHf (eV) experiment
Bi2WO6 –14.98 –11.5273
Bi2O3 –5.86 –5.9576
WO2 –5.75 –6.1176
WO3 –8.32 –8.7476
CO –0.71 –1.1476
CO2 –3.91 –4.0876
P2O5 –14.38  
SO2 –3.06 –3.0876
SO3 –4.13  
Bi2S3 –1.78 –1.4876
WC –0.41  
N2O5 –0.42 –0.4576
a

Experimental values at 298 K are provided for comparison (unit: eV).