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Topic Area: Spectroscopy
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Displaying records 101 to 104.
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101. To Predict Vibrational Spectra, Are Anharmonic Calculations Worthwhile?
Topic: Spectroscopy
Published: 1/22/2013
Authors: Ruth Lafuente Jacobsen, Karl K Irikura, Russell D Johnson III, Raghu N Kacker
Abstract: Anharmonic calculations using vibrational perturbation theory are known to provide near-spectroscopic accuracy when combined with high-level ab initio potential energy functions. However, performance with economical, popular electronic structure meth ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=911024

102. Ultrafast Transient THz Spectroscopy of Azobenzene
Topic: Spectroscopy
Published: 1/1/2005
Authors: Okan Esenturk, Edwin J Heilweil
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=104459

103. Using DTSA-II to Simulate and Interpret Energy Dispersive Spectra from Particles
Topic: Spectroscopy
Published: 2/27/2010
Author: Nicholas W m Ritchie
Abstract: A high quality x-ray spectrum image of a 3.3 μm diameter sphere of K411 glass resting on a copper substrate was collected at 25 keV. The same sample configuration was modeled using the NISTMonte Monte Carlo simulation of electron and x-ray tra ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=902046

104. Vibrationally-Resolved Sum-Frequency Generation With Broad Bandwidth Infrared Pulses
Topic: Spectroscopy
Published: 10/15/1998
Authors: Lee J Richter, T Petralli-Mallow, John C. Stephenson
Abstract: We present a novel procedure for vibrationally-resolved sum-frequency generation (SFG) in which a broad-bandwidth IR pulse is mixed with a narrow-bandwidth visible pulse. The resultant SFG spectrum is dispersed with a spectrograph and detected in pa ...
http://www.nist.gov/manuscript-publication-search.cfm?pub_id=831071



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