In this review, we report recent progress in the field of supercooled water. Due to its
uniqueness, water presents numerous anomalies with respect to most simple liquids …

The average dipole moment of a water molecule in the condensed phase is enhanced by
around 40 percent relative to that of an isolated monomer. This enhancement results from …

We study with ab initio molecular dynamics the change that the electric dipole moment of
water molecules undergoes in passing from the gas to the liquid phase. Our analysis is …

We study, from first principles, structural, electronic, and bonding properties of liquid water.
Our system is twice as large as that used in previous ab initio simulations and our computed …

Using the theory of atoms in molecules (AIM), the intermolecular interactions, including
hydrogen bonds (HBs) and the new intermolecular bonds (O–O) found recently in ice IX, ice …

Four scenarios have been proposed for the low-temperature phase behavior of liquid water,
each predicting different thermodynamics. The physical mechanism that leads to each is …

Textbooks increasingly include material concerning the importance of water but this topic is
often treated over-simplistically with insufficient attention being given to the central position …

The dipole moment of a polar liquid, such as water, is a fundamental property of its
molecules and is a basic ingredient for characterizing its local environment. While it may not …

Recent simulation studies for four dipole-polarizable and for two fluctuating-charge water
force fields have demonstrated that none of the force fields studied is capable of yielding a …

A shell-model water potential, derived to be compatible with existing potential models for
inorganic solids, is introduced. It reproduces experimental data of the water monomer and …