Improving Drinking Water Quality in South Korea: A Choice Experiment with Hypothetical Bias Treatments

The objective of this present study is to use choice experiments and an extensive cost-benefit analysis (CBA) to investigate the feasibility of installing two advanced water treatments in Cheongju waterworks in South Korea. The study uses latent class attribute non-attendance models in a choice experiment setting in order to estimate the benefits of the two water treatments. Moreover, it explores strategies to mitigate potential hypothetical bias as this has been the strongest criticism brought to stated preference methods to date. Hypothetical bias is the difference between what people state in a survey they would be willing to pay and what they would actually pay in a real situation. The study employs cheap talk with a budget constraint reminder and honesty priming with the latter showing more evidence of reducing potential hypothetical bias. The lower bound of the median WTP (willingness to pay) for installing a new advanced water treatment system is approximately $2 US/month, similar to the average expenditures for bottled water per household in South Korea. These lower bounds were found using bootstrapping and simulations. The CBA shows that one of the two treatments, granular activated carbon is more robust to sensitivity analyses, making this the recommendation of the stud

Superprotonic phase transition of CsHSO4: A molecular dynamics simulation study

The superprotonic phase transition (phase II --> phase I; 414 K) of cesium hydrogen sulfate, CsHSO4, was simulated using molecular dynamics with the "first principles" MSXX force field (FF). The structure, binding energy, and vibrational frequencies of the CsHSO4 monomer, the binding energy of the (H2SO4)2 dimer, and the torsion barrier of the HSO4- ion were determined from quantum mechanical calculations, and the parameters of the Dreiding FF for Cs, S, O, and H adjusted to reproduce these quantities. Each hydrogen atom was treated as bonded exclusively to a single oxygen atom (proton donor), but allowed to form hydrogen bonds to various second nearest oxygen atoms (proton acceptors). Fixed temperature-pressure (NPT) dynamics were employed to study the structure as a function of temperature from 298 to 723 K. In addition, the influence of several force field parameters, including the hydrogen torsional barrier height, hydrogen bond strength, and oxygen charge distribution, on the structural behavior of CsHSO4 was probed. Although the FF does not allow proton migration (i.e., proton jumps) between oxygen atoms, a clear phase transition occurred as demonstrated by a discrete change of unit cell symmetry (monoclinic to tetragonal), cell volume, and molar enthalpy. The dynamics of the HSO4- group reorientational motion also changed dramatically at the transition. The observation of a transition to the expected tetragonal phase using a FF in which protons cannot migrate indicates that proton diffusion does not drive the transition to the superprotonic phase. Rather, high conductivity is a consequence of the rapid reorientations that occur in the high temperature phase. Furthermore, because no input from the superprotonic phase was employed in these simulations, it may be possible to employ MD to hypothesize superprotonic materials

Isometric Representations of Totally Ordered Semigroups

Let S be a subsemigroup of an abelian torsion-free group G. If S is a positive cone of G, then all C*-algebras generated by faithful isometrical non-unitary representations of S are canonically isomorphic. Proved by Murphy, this statement generalized the well-known theorems of Coburn and Douglas. In this note we prove the reverse. If all C*-algebras generated by faithful isometrical non-unitary representations of S are canonically isomorphic, then S is a positive cone of G. Also we consider G = Z\times Z and prove that if S induces total order on G, then there exist at least two unitarily not equivalent irreducible isometrical representation of S. And if the order is lexicographical-product order, then all such representations are unitarily equivalent.Comment: February 21, 2012. Kazan, Russi

Free energy barrier for molecular motions in bistable [2]rotaxane molecular electronic devices

Donor−acceptor binding of the π-electron-poor cyclophane cyclobis(paraquat-p-phenylene) (CBPQT^(4+)) with the π-electron-rich tetrathiafulvalene (TTF) and 1,5-dioxynaphthalene (DNP) stations provides the basis for electrochemically switchable, bistable [2]rotaxanes, which have been incorporated and operated within solid-state devices to form ultradense memory circuits (ChemPhysChem 2002, 3, 519−525; Nature 2007, 445, 414−417) and nanoelectromechanical systems. The rate of CBPQT^(4+) shuttling at each oxidation state of the [2]rotaxane dictates critical write-and-retention time parameters within the devices, which can be tuned through chemical synthesis. To validate how well computational chemistry methods can estimate these rates for use in designing new devices, we used molecular dynamics simulations to calculate the free energy barrier for the shuttling of the CBPQT^4+ ring between the TTF and the DNP. The approach used here was to calculate the potential of mean force along the switching pathway, from which we calculated free energy barriers. These calculations find a turn-on time after the rotaxane is doubly oxidized of ~10^9−7) s (suggesting that the much longer experimental turn-on time is determined by the time scale of oxidization). The return barrier from the DNP to the TTF leads to a predicted lifetime of 2.1 s, which is compatible with experiments

Catastrophic vs Gradual Collapse of Thin-Walled Nanocrystalline Ni Hollow Cylinders As Building Blocks of Microlattice Structures

Lightweight yet stiff and strong lattice structures are attractive for various engineering applications, such as cores of sandwich shells and components designed for impact mitigation. Recent breakthroughs in manufacturing enable efficient fabrication of hierarchically architected microlattices, with dimensional control spanning seven orders of magnitude in length scale. These materials have the potential to exploit desirable nanoscale-size effects in a macroscopic structure, as long as their mechanical behavior at each appropriate scale – nano, micro, and macro levels – is properly understood. In this letter, we report the nanomechanical response of individual microlattice members. We show that hollow nanocrystalline Ni cylinders differing only in wall thicknesses, 500 and 150 nm, exhibit strikingly different collapse modes: the 500 nm sample collapses in a brittle manner, via a single strain burst, while the 150 nm sample shows a gradual collapse, via a series of small and discrete strain bursts. Further, compressive strength in 150 nm sample is 99.2% lower than predicted by shell buckling theory, likely due to localized buckling and fracture events observed during in situ compression experiments. We attribute this difference to the size-induced transition in deformation behavior, unique to nanoscale, and discuss it in the framework of “size effects” in crystalline strength

Permutation sampling in Path Integral Monte Carlo

A simple algorithm is described to sample permutations of identical particles in Path Integral Monte Carlo (PIMC) simulations of continuum many-body systems. The sampling strategy illustrated here is fairly general, and can be easily incorporated in any PIMC implementation based on the staging algorithm. Although it is similar in spirit to an existing prescription, it differs from it in some key aspects. It allows one to sample permutations efficiently, even if long paths (e.g., hundreds, or thousands of slices) are needed. We illustrate its effectiveness by presenting results of a PIMC calculation of thermodynamic properties of superfluid Helium-four, in which a very simple approximation for the high-temperature density matrix was utilized

On the existence of solutions to the relativistic Euler equations in 2 spacetime dimensions with a vacuum boundary

We prove the existence of a wide class of solutions to the isentropic relativistic Euler equations in 2 spacetime dimensions with an equation of state of the form $p=K\rho^2$ that have a fluid vacuum boundary. Near the fluid vacuum boundary, the sound speed for these solutions are monotonically decreasing, approaching zero where the density vanishes. Moreover, the fluid acceleration is finite and bounded away from zero as the fluid vacuum boundary is approached. The existence results of this article also generalize in a straightforward manner to equations of state of the form $p=K\rho^\frac{\gamma+1}{\gamma}$ with $\gamma > 0$.Comment: A major revision of the second half of the pape

Dynamical dark energy: Current constraints and forecasts

We consider how well the dark energy equation of state $w$ as a function of red shift $z$ will be measured using current and anticipated experiments. We use a procedure which takes fair account of the uncertainties in the functional dependence of $w$ on $z$, as well as the parameter degeneracies, and avoids the use of strong prior constraints. We apply the procedure to current data from WMAP, SDSS, and the supernova searches, and obtain results that are consistent with other analyses using different combinations of data sets. The effects of systematic experimental errors and variations in the analysis technique are discussed. Next, we use the same procedure to forecast the dark energy constraints achieveable by the end of the decade, assuming 8 years of WMAP data and realistic projections for ground-based measurements of supernovae and weak lensing. We find the $2 \sigma$ constraints on the current value of $w$ to be $\Delta w_0 (2 \sigma) = 0.20$, and on $dw/dz$ (between $z=0$ and $z=1$) to be $\Delta w_1 (2 \sigma)=0.37$. Finally, we compare these limits to other projections in the literature. Most show only a modest improvement; others show a more substantial improvement, but there are serious concerns about systematics. The remaining uncertainty still allows a significant span of competing dark energy models. Most likely, new kinds of measurements, or experiments more sophisticated than those currently planned, are needed to reveal the true nature of dark energy.Comment: 24 pages, 20 figures. Added SN systematic uncertainties, extended discussio