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[PENDING] On the prediction of thermal stability of nitroaromatic compounds using quantum chemical calculations

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Fig. 2. Plot of (a) molecular weight and (b) mean polarizability with the experimental decomposition enthalpy
Fig. 3. Calculated vs experimental decomposition enthalpies (kJ/mol).
Table 1: Experimental decomposition enthalpies (-∆H exp /kJ/mol) of the 22 substituted nitrobenzene molecules from [30]
Table 2: Descriptors.
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