Collinear quasiclassical trajectory study of collision-induced dissociation on a model potential energy surface

Quasiclassical trajectory calculations have been carried out at energies above the threshold for collision-induced dissociation for a model symmetric collinear atom–diatomic molecule system. Exact quantum mechanical calculations have shown that quasiclassical trajectories give a qualitatively correct picture of the dynamics in this system, in so far as reaction and total dissociation probabilities are concerned. Trajectories leading to dissociation are found to lie almost entirely in well-defined reactivity bands, with the exception of a few occurring in a small chattering region in which the outcome of the trajectory is extremely sensitive to its initial conditions. The energy distribution functions of the dissociated atoms are obtained and shown to vary substantially with initial conditions (reagent vibrational and translation energy). The form of these distributions is, to a major extent, determined by the position and width of the reactivity bands. The different dissociation reactivity bands are shown to be associated with different types of trajectories. Part of the vibrational enhancement of dissociation arises from the fact that the simplest possible trajectory leading to dissociation (one which crosses the symmetric stretch line only once prior to the onset of dissociation) is not obtained with ground state reagents

The ATLAS Series of Shuttle Missions

The ATLAS space shuttle missions were conducted in March 1992, April 1993, and November 1994. The ATLAS payload and companion instruments made measurements of solar irradiance and middle atmospheric temperatures and trace gas concentrations. The solar irradiance measurements included total and spectrally resolved solar irradiance. The atmospheric measurements included microwave, infrared, and ultraviolet limb sounding, nadir ultraviolet backscatter, and solar occultation techniques. This paper introduces a special section in this issue of Geophysical Research Letters

Analysis of stratospheric ozone, temperature, and minor constituent data

The objective of this research is to use available satellite measurements of temperature and constituent concentrations to test the conceptual picture of stratospheric chemistry and transport. This was originally broken down into two sub-goals: first, to use the constituent data to search for critical tests of our understanding of stratospheric chemistry and second, to examine constituent transport processes emphasizing interactions with chemistry on various time scales. A third important goal which has evolved is to use the available solar backscattered ultraviolet (SBUV) and Total Ozone Mapping Spectrometer (TOMS) data from Nimbus 7 to describe the morphology of recent changes in Antarctic and global ozone with emphasis on searching for constraints to theories. The major effort now being pursued relative to the two original goals is our effort as a theoretical team for the Arctic Airborne Stratospheric Expedition (AASE). Our effort for the AASE is based on the 3D transport and chemistry model at Goddard. Our goal is to use this model to place the results from the mission data in a regional and global context. Specifically, we set out to make model runs starting in late December and running through March of 1989, both with and without heterogeneous chemistry. The transport is to be carried out using dynamical fields from a 4D data assimilation model being developed under separate funding from this task. We have successfully carried out a series of single constituent transport experiments. One of the things demonstrated by these runs was the difficulty in obtaining observed low N2O abundances in the vortex without simultaneously obtaining very high ozone values. Because the runs start in late December, this difficulty arises in the attempt to define consistent initial conditions for the 3D model. To accomplish a consistent set of initial conditions, we are using the 2D photochemistry-transport model of Jackman and Douglass and mapping in potential temperature, potential vorticity space as developed by Schoeberl and coworkers

Satellite observation and mapping of wintertime ozone variability in the lower stratosphere

Comparison is made between 30 mbar ozone fields that are generated by a transport chemistry model utilizing the winds from the Goddard Space Flight Center stratospheric data assimilation system (STRATAN), observations from the LIMS instrument on Nimbus-7, and the ozone fields that result from 'flying a mathematical simulation of LIMS observations through the transport chemistry model ozone fields. The modeled ozone fields were found to resemble the LIMS observations, but the model fields show much more temporal and spatial structure than do the LIMS observations. The 'satellite mapped' model results resemble the LIMS observations much more closely. These results are very consistent with the earlier discussions of satellite space-time sampling by Salby

Aspen Global Change Institute Summer Science Sessions

The Aspen Global Change Institute (AGCI) successfully organized and convened six interdisciplinary meetings over the course of award NNG04GA21G. The topics of the meetings were consistent with a range of issues, goals and objectives as described within the NASA Earth Science Enterprise Strategic Plan and more broadly by the US Global Change Research Program/Our Changing Planet, the more recent Climate Change Program Strategic Plan and the NSF Pathways report. The meetings were chaired by two or more leaders from within the disciplinary focus of each session. 222 scholars for a total of 1097 participants-days were convened under the auspices of this award. The overall goal of each AGCI session is to further the understanding of Earth system science and global environmental change through interdisciplinary dialog. The format and structure of the meetings allows for presentation by each participant, in-depth discussion by the whole group, and smaller working group and synthesis activities. The size of the group is important in terms of the group dynamics and interaction, and the ability for each participant's work to be adequately presented and discussed within the duration of the meeting, while still allowing time for synthesi

Stratospheric General Circulation with Chemistry Model (SGCCM)

In the past two years constituent transport and chemistry experiments have been performed using both simple single constituent models and more complex reservoir species models. Winds for these experiments have been taken from the data assimilation effort, Stratospheric Data Analysis System (STRATAN)

A Water-Damaged Home and Health of Occupants: A Case Study

A family of five and pet dog who rented a water-damaged home and developed multiple health problems. The home was analyzed for species of mold and bacteria. The diagnostics included MRI for chronic sinusitis with ENT and sinus surgery, and neurological testing for neurocognitive deficits. Bulk samples from the home, tissue from the sinuses, urine, nasal secretions, placenta, umbilical cord, and breast milk were tested for the presence of trichothecenes, aflatoxins, and Ochratoxin A. The family had the following diagnosed conditions: chronic sinusitis, neurological deficits, coughing with wheeze, nose bleeds, and fatigue among other symptoms. An infant was born with a total body flare, developed multiple Cafe-au-Lait pigmented skin spots and diagnoses with NF1 at age 2. The mycotoxins were detected in bulk samples, urine and nasal secretions, breast milk, placenta, and umbilical cord. Pseudomonas aueroginosa, Acinetobacter, Penicillium, and Aspergillus fumigatus were cultured from nasal secretions (father and daughter). RT-PCR revealed A. fumigatus DNA in sinus tissues of the daughter. The dog had 72 skin lesions (sebaceous glands and lipomas) from which trichothecenes and ochratoxin A. were detected. The health of the family is discussed in relation to the most recent published literature regarding microbial contamination and toxic by-products present in water-damaged buildings

Present state of knowledge of the upper atmosphere1993: An assessment report, part 2

This document is issued in response to the Clean Air Act Amendment of 1990, Public Law 101-549, which mandates that the National Aeronautics and Space Administration (NASA) and other key agencies submit triennial reports to Congress and the Environmental Protection Agency. NASA is charged with the responsibility to report on the state of our knowledge of the earth's upper atmosphere, particularly the stratosphere. Part 2 (this document) presents summaries of several scientific assessments of our current understanding of the chemical composition and physical structure of the stratosphere, in particular how the abundance and distribution of ozone is predicted to change in the future. These reviews include: (Section B) 'Scientific Assessment of Ozone Depletion: 1991'; (Section C) 'Methyl bromide and the Ozone Layer: A Summary of Current Understanding', published in 1992; (Section D) 'Concentrations, Lifetimes, and Trends of Chlorofluorocarbons (CFC's), Halons, and Related Molecules in the Atmosphere'; (Section E) 'The Atmospheric Effects of Stratospheric Aircraft: Interim Assessment Report of the NASA High-Speed Research Program'; (Section F) 'Chemical Kinetics and Photochemical Data for Use in Stratospheric Modeling'; and (Section G) a list of the contributors to this report

Buprenorphine and its formulations: a comprehensive review.

Buprenorphine, a novel long-acting analgesic, was developed with the intention of two purposes: analgesia and opioid use disorder. Regarding its pharmacodynamics, it is a partial agonist at mu receptors, an inverse agonist at kappa receptors, and an antagonist at delta receptors. For the purpose of analgesia, three formulations of buprenorphine were developed: IV/IM injectable formulation (Buprenex®), transdermal patch formulation (Butrans®), and buccal film formulation (Belbuca®). Related to opioid dependence, the formulations developed were subcutaneous extended release (Sublocade®), subdermal implant (Probuphine®), and sublingual tablets (Subutex®). Lastly, in order to avoid misuse of buprenorphine for opioid dependence, two combination formulations paired with naloxone were developed: film formulation (Suboxone®) and tablet formulation (Zubsolv®). In this review, we present details of each formulation along with their similarities and differences between each other and clinical considerations