title: [Ortho/para spin-isomers of H2O molecules as a factor responsible for formation of two structural motifs in water].
abstract: According to the last results obtained by small-angle X-ray scattering and X-ray spectroscopy it was suggested that water within the nanometer scale represents a fluctuating mixture of clusters with tetrahedral structure and a subphase with partially broken hydrogen bonds whereas the nuclear configuration of the H20 molecule corresponds to single tetrahedral coordination. The basic reason of such structural partition is not clear until now. Here we show that it can be associated with the existence of two nuclear H2O spin-isomers which have different probability to be in one or another subphase. The para-molecule can transfer an excess of its rotational energy to the environment up to the complete stopping of rotation because its rotational quantum number J = 0 in the basic state. This property is favorable for the formation of clusters with closed H-bonds. Ortho-molecules with odd-numbered J states lack for this property and thus should be predominantly present in the surrounding with distorted bonds.
authors.forename: S D
authors.initials: SD
authors.lastname: Zakharov
mesh_terms: D006860:Hydrogen Bonding; D007536:Isomerism; D011789:Quantum Theory; D013057:Spectrum Analysis; D014867:Water / Q000737:chemistry*
chemical_list: D014867:Water