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Topic Area: Molecular Physics
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21. The Infrared Spectrum of HOOH+ Trapped in Solid Neon
Topic: Molecular Physics
Published: 10/12/2012
Authors: Warren Elwin Thompson, Catherine L. Lugez, Marilyn E Jacox
Abstract: When a Ne:H2O2 mixture is codeposited at 4.3 K with a beam of neon atoms that have been excited in a microwave discharge, three new, photosensitive absorptions appear which can be assigned to the three infrared-active fundamentals of trans-HOOH+. Wh ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=911738

22. The Infrared Spectrum of NN...CO+ Trapped in Solid Neon
Topic: Molecular Physics
Published: 12/15/2011
Authors: Warren Elwin Thompson, Marilyn E Jacox
Abstract: Codeposition of a Ne:N2:CO = 200:1:1 mixture at 4.3 K with a beam of very pure neon atoms excited to their energy levels between 16.6 and 16.85 eV leads to stabilization in the resulting solid of sufficient NNCO+ for detection of its NN- and CO-stret ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=909909

23. The Laboratory Founded by Van der Waals
Topic: Molecular Physics
Published: 1/1/2001
Author: Johanna M.H. Levelt-Sengers
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=906710

24. The Temperature Dependence of the Molecular Structure Parameters in SF^d6^
Topic: Molecular Physics
Published: 8/15/1982
Authors: Michael H Kelley, M Fink
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=620232

25. The water-oxygen dimer: first-principles calculation of an extrapolated potential energy surface and second virial coefficients.
Topic: Molecular Physics
Published: 8/20/2007
Authors: Allan H Harvey, Richard J. Wheatley
Abstract: The Systematic Intermolecular Potential Extrapolation Routine (SIMPER) is applied to the water-oxygen complex to obtain a five-dimensional potential energy surface. This is the first application of SIMPER to open-shell molecules, and it is the first ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=50514

26. Transport Coefficients and Molecular Dynamics: Altermatives
Series: NIST Interagency/Internal Report (NISTIR)
Report Number: 7170
Topic: Molecular Physics
Published: 10/4/2004
Author: Raymond Dale Mountain
Abstract: The task of using molecular dynamics to determine the shear viscosity and the thermal conductivity of a model fluid is examined in detail for the Lennard-Jones fluid. The equilibrium time correlation function approach is compared with three nonequil ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=831950

27. Ultrafast Dynamics of Model Molecular Photoswitches in Solid Phase
Topic: Molecular Physics
Published: 12/18/2007
Authors: Tung T. To, Edwin J Heilweil
Abstract: Ultraviolet pump, infrared probe transient absorption studies of the chelatable compound 1, [Mn{?5-C5H4C(O)(SCH3)3}(CO)3], dispersed in room temperature, ~25 m thick polyacryclonitrile (PAN) films are reported for the first time. Irradiation of 1 ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=841099