Temperature dependence of results for liquid TIP4P watera.
| Temp (C) | ΔGaq | ΔHvap | Density |
|---|---|---|---|
| 15 | −6.402 | 10.788 | 1.00822 |
| 20 | −6.294 | 10.719 | 1.00567 |
| 25 | −6.190 | 10.654 | 1.00294 |
| 30 | −6.206 | 10.582 | 0.99960 |
| 35 | −6.080 | 10.515 | 0.99722 |
| 40 | −5.933 | 10.451 | 0.99329 |
| 45 | −5.945 | 10.387 | 0.98915 |
Energies in kcal mol−1; density in g cm−3. Pressure is 1 atm.