Determination of Fares: Pricing Theory and Economic Efficiency

The concept of economic efficiency is described, its application to the pricing of air transport services, and its relevance as a policy objective are outlined. The first two sections discuss economic efficiency in general terms, whereas the third applies this norm to several airline pricing problems. The final section emphasizes the importance of industry behavior as a parameter in policy analysis

Incident shock-wave characteristics in air, argon, carbon dioxide, and helium in a shock tube with unheated helium driver

Incident shock-wave velocities were measured in the Langley 6-inch expansion tube, operated as a shock tube, with air, argon, carbon dioxide, and helium as test gases. Unheated helium was used as the driver gas and most data were obtained at pressures of approximately 34 and 54 MN/sq m. A range of pressure ratio across the diaphragm was obtained by varying the quiescent test-gas pressure, for a given driver pressure, from 0.0276 to 34.5 kN/sq m. Single- and double-diaphragm modes of operation were employed and diaphragms of various materials tested. Shock velocity was determined from microwave interferometer measurements, response of pressure transducers positioned along interferometer measurements, response of pressure transducers positioned along the driven section (time-of-arrival gages), and to a lesser extent, measured tube-wall pressure. Velocities obtained from these methods are compared and limitations of the methods discussed. The present results are compared with theory and the effects of diaphragm mode (single or double diaphragm), diaphragm material, heating of the driver gas upon pressurization of the driver section, diaphragm opening time, interface mixing, and two-dimensional (nonplanar) flow are discussed

Experimental perfect-gas study of expansion-tube flow characteristics

Results of an experimental investigation of expansion tube flow characteristics performed with helium test gas and acceleration gas are presented. The use of helium, eliminates complex real gas chemistry in the comparison of measured and predicted flow quantities. The driver gas was unheated helium at a nominal pressure of 33 MN sq m. The quiescent test gas pressure and quiescent acceleration gas pressure were varied from 0.7 to 50 kN/sq m and from 2.5 to 53 N/sq m, respectively. The effects of tube-wall boundary layer growth and finite secondary diaphragm opening time were examined through the variation of the quiescent gas pressures and secondary diaphragm thickness. Optimum operating conditions for helium test gas were also defined

Tables and charts of equilibrium thermodynamic properties of ammonia for temperatures from 500 to 50,000 K.

Equilibrium thermodynamic properties for pure ammonia were generated for a range of temperature from 500 to 50,000 K and pressure from 0.01 to 40 MN/sq m and are presented in tabulated and graphical form. Properties include pressure, temperature, density, enthalpy, speed of sound, entropy, molecular-weight ratio, specific heat at constant pressure, specific heat at constant volume, isentropic exponent, and species mole fractions. These properties were calculated by the method which is based on minimization of the Gibbs free energy. The data presented herein are for an 18-species ammonia model. Heats of formation and spectroscopic constants used as input data are presented. Comparison of several thermodynamic properties calculated with the present program and a second computer code is performed for a range of pressure and for temperatures up to 30,000 K

Collision-induced conformational changes in glycine

We present quantum dynamical calculations on the conformational changes of glycine in collisions with the He, Ne, and Ar rare-gas atoms. For two conformer interconversion processes (III-->I and IV-->I), we find that the probability of interconversion is dependent on several factors, including the energy of the collision, the angle at which the colliding atom approaches the glycine molecule, and the strength of the glycine-atom interaction. Furthermore, we show that attractive interactions between the colliding atom and the glycine molecule catalyze conformer interconversion at low collision energies. In previous infrared spectroscopy studies of glycine trapped in rare-gas matrices and helium clusters, conformer III has been consistently observed, but conformer IV has yet to be conclusively detected. Because of the calculated thermodynamic stability of conformer IV, its elusiveness has been attributed to the IV-->I conformer interconversion process. However, our calculations present little indication that IV-->I interconversion occurs more readily than III-->I interconversion. Although we cannot determine whether conformer IV interconverts during experimental Ne- and Ar-matrix depositions, our evidence suggests that the conformer should be present in helium droplets. Anharmonic vibrational frequency calculations illustrate that previous efforts to detect conformer IV may have been hindered by the overlap of its IR-absorption bands with those of other conformers. We propose that the redshifted symmetric –CH2 stretch of conformer IV provides a means for its conclusive experimental detection

Potential applications of digital, visible, and infrared data from geostationary environmental satellites

An hourly, digital data base from the Visible/Infrared Spin-Scan Radiometer (VISSR) instrument on the GOES-1 and SMS-2 geostationary satellites is described. Several examples of developmental applications of these quantitative digital data are presented. These include a review of recent attempts to develop products that are of use to meteorologists who provide services to aviation, agriculture, forestry, hydrology, oceanography, and climatology. The sample products include high resolution thermal gradients of land and ocean surfaces, thermal change analyses, fruit frost/freeze application, cloud-top altitude analysis, analysis of hurricane characteristics, and analyses of solar insolation

Correcting density-driven errors in projection-based embedding

Projection-based embedding provides a simple and numerically robust framework for multiscale wavefunction-in-density-functional-theory (WF-in-DFT) calculations. The approach works well when the approximate DFT is sufficiently accurate to describe the energetics of the low-level subsystem and the coupling between subsystems. It is also necessary that the low-level DFT produces a qualitatively reasonable description of the total density, and in this work, we study model systems where delocalization error prevents this from being the case. We find substantial errors in embedding calculations on open-shell doublet systems in which self-interaction errors cause spurious delocalization of the singly occupied orbital. We propose a solution to this error by evaluating the DFT energy using a more accurate self-consistent density, such as that of Hartree-Fock (HF) theory. These so-called WF-in-(HF-DFT) calculations show excellent convergence towards full-system wavefunction calculations

Structurally detailed coarse-grained model for Sec-facilitated co-translational protein translocation and membrane integration

We present a coarse-grained simulation model that is capable of simulating the minute-timescale dynamics of protein translocation and membrane integration via the Sec translocon, while retaining sufficient chemical and structural detail to capture many of the sequence-specific interactions that drive these processes. The model includes accurate geometric representations of the ribosome and Sec translocon, obtained directly from experimental structures, and interactions parameterized from nearly 200 μs of residue-based coarse-grained molecular dynamics simulations. A protocol for mapping amino-acid sequences to coarse-grained beads enables the direct simulation of trajectories for the co-translational insertion of arbitrary polypeptide sequences into the Sec translocon. The model reproduces experimentally observed features of membrane protein integration, including the efficiency with which polypeptide domains integrate into the membrane, the variation in integration efficiency upon single amino-acid mutations, and the orientation of transmembrane domains. The central advantage of the model is that it connects sequence-level protein features to biological observables and timescales, enabling direct simulation for the mechanistic analysis of co-translational integration and for the engineering of membrane proteins with enhanced membrane integration efficiency

Anti-Adhesion Elastomer Seal Coatings for Ultraviolet and Atomic Oxygen Protection

Radiation blocking sunscreen coatings have been developed for the protection of elastomer seals used in low-Earth-orbit (LEO). The coatings protect the seals from ultraviolet (UV) radiation and atomic oxygen (AO) damage. The coatings were developed for use on NASA docking seals. Docking seal damage from the UV and AO present in LEO can constrain mission time-line, flight mode options, and increases risk. A low level of adhesion is also required for docking seals so undocking push-off forces can be low. The coatings presented also mitigate this unwanted adhesion. Greases with low collected volatile condensable materials (CVCM) and low total mass loss (TML) were mixed with slippery and/or UV blocking powders to create the protective coatings. Coatings were applied at rates up to 2 milligrams per square centimeter. Coated seals were exposed to AO and UV in the NUV (near-UV) and UV-C wavelength ranges (300 to 400 nanometers and 254 nanometers, respectively). Ground based ashers were used to simulate the AO of space. The Sun's UV energy was mimicked assuming a nose forward flight mode, resulting in an exposure rate of 2.5 megajoules per square meter per day. Exposures between 0 and 147 megajoules per square meter (UV-C) and 245 megajoules per square meter (NUV) were accomplished. The protective coatings were durable, providing protection from UV after a simulated docking and undocking cycle. The level of protection begins to decline at coverage rates less than 0.9 milligrams per square centimeter. The leakage of seals coated with Braycote plus 20 percent Z-cote ZnO sunscreen increased by a factor of 40 after moderate AO exposure; indicating that this coating might not be suitable due to AO intolerance. Seals coated with DC-7-16.4 percent Z-cote ZnO sunscreen were not significantly affected by combined doses of 2 x 10 (sup 21) atoms per square AO with 73 megajoules per square meter UV-C. Unprotected seals were significantly damaged at UV-C exposures of 0.3 megajoules per square meter and DC-7-16.4 percent Z-cote coated seals were undamaged at all exposures up to the limits tested thus far which were 147 megajoules per square meter UV-C and 245 megajoules per square meter NUV. The coatings decreased adhesion sufficiently for docking seals at temperatures equal to or greater than -8 degrees Centigrade thus offer a simple and inexpensive way to mitigate adhesion