The effect of androsterol, whose structure resembles that of cholesterol but without the alkyl side chain, on the phase behavior of aqueous dispersions of dipalmitoylphosphatidylcholine has been studied to understand the role of the side chain played in the formation of ordered phases of the type observed in membrane rafts. Thermotropic changes in the structure of mixed dispersions and transiti...

The formation of an excess of dissolved gas (“excess air”) in quasi-saturated media was studied by analyzing and interpreting dissolved noble gas concentrations in laboratory column experiments. Using quartz sand filled columns of 1 m length, two different experimental designs were realized. In the first, groundwater recharge was simulated by a unidirectional vertical water flow through the col...

As a simple model of rafts in plant cells, the effect of stigmasterol, one of the predominant sterols in plant plasma membranes, on the phase behavior of dipalmitoylphosphatidylcholine (DPPC) multilayers has been studied by X-ray diffraction (XRD), differential scanning calorimetry (DSC), and freeze-fracture electron microscopy (FFEM) techniques. A partial phase diagram of the binary system has...

Grotthuss shuttling of an excess proton charge defect through hydrogen bonded water networks has long been the focus of theoretical and experimental studies. In this work we show that there is a related process in which water molecules move ("shuttle") through a hydrated excess proton charge defect in order to wet the path ahead for subsequent proton charge migration. This process is illustrate...

To explain a difference of 0.5 % between the absorbed-dose standards of the National Institute of Standards and Technology (NIST) and the National Research Council of Canada (NRCC), Seuntjens et al. suggest the fault lies with the NIST water calorimeter being operated at 22 °C and the method with which the measurements were made. Their calculations show that this difference is due to overpredic...

We present approximate pseudopotential quantum-mechanical calculations of the excess electron states of equilibrated neutral water clusters sampled by classical molecular dynamics simulations. The internal energy of the clusters are representative of those present at temperatures of 200 and 300 K. Correlated electronic structure calculations are used to validate the pseudopotential for this pur...

Abstract In order to evaluate crop water stress index (CWSI) and canopy temperature of wheat cultivars under terminal drought stress, a field experiment was conducted at the Agricultural Research Station of Shiraz University, Shiraz, during 2009 growing season. Five wheat cultivars including Shiraz, Bahar, Pishtaz, Sistan and Yavaros and four levels of water regime including well watering [Irr...

We show that the anomalous negative excess entropy of mixing characteristic of aqueous lower alcohols containing hydrophobic groups is quantitatively consistent with a model exploiting only the experimentally observed molecular-scale segregation of the components across the entire concentration range. The simple model presented here, which uses plausible interatomic distances as its only free p...

Persistent above average precipitation and runoff and associated increased sediment transfers from cultivated ecosystems to rivers and oceans are due to changes in climate and human action. The US Upper Midwest has experienced a 37% increase in precipitation (1958-2012), leading to increased crop damage from excess water and off-farm loss of soil and nutrients. Farmer adaptive management respon...

We have performed mixed quantum-classical molecular dynamics simulations of the relaxation of a ground state excess electron at interfaces of different phases of water with air. The investigated systems included ambient water/air, supercooled water/air, Ih ice/air, and amorphous solid water/air interfaces. The present work explores the possible connections of the examined interfacial systems to...