Fast and accurate determination of phase transition temperature via individual generalized canonical ensemble simulation
Shao Ming-Zhe1, Wang Yan-Ting2, Zhou Xin3, †
       

The temperatures obtained in the gNPT simulations. Cyan region refers to 274.6 ± 1 K, the melting point of the mW water model proposed in previous study.[7] Tc = 275.1 ± 0.3 K is the average of six simulations located in the phase-coexistence region.