화학공학소재연구정보센터
Journal of Physical Chemistry B, Vol.116, No.50, 14660-14666, 2012
Estimate of Beryllium Critical Point on the Basis of Correspondence between the Critical and the Zeno-Line Parameters
The critical-point coordinates of Beryllium have been calculated by means of recently found similarity relations between the Zeno-line and the critical-point parameters. We have used the NVT MC simulations and pseudopotential theory to calculate the Zeno-line parameters together with the data of isobaric measurements to construct the liquid branch of Beryllium binodal. The critical-point coordinates, determined this way, are lower than earlier estimates. We have shown that these previous estimates are in evident contradiction with available measurements data. Present investigation can resolve this contradiction if the measurements data are supposed to be reliable.