Table 1 Estimated pressure \(P_c\), temperature \(T_c\), and density \(\rho _c\) of the LLCP of q-TIP4P/F H\(_2\)O. Values of \(P_c\), \(T_c\), and \(\rho _c\) are obtained by using the TSEOS in combination with data from classical MD and PIMD simulations at \(180\le T \le 325\) K. Numbers in parenthesis are standard deviations.
PIMD | Classical MD | |
|---|---|---|
\(P_c\) | 167 (9) | 203 (4) |
\(T_c\) | 159 (6) | 175 (1) |
\(\rho _c\) | 1.02 (0.01) | 1.03 (0.01) |