“…It could be discerned that the calculated heat capacities of La and A-La 2 O 3 from the present study are in good agreement with experimental results in the literature, and the present C P of dhcp La seem a little bit closer to the experimental values than those from the phonon calculations [38]. For instance, the present C P of dhcp La and A-La 2 O 3 at 50 K are 15.5 and 17.5 J/mol/K, respectively, consistent with the corresponding values of 18.1 and 22.9 J/mol/K from experiments [43,63,20]. One can also see clearly from Fig.…”