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The 1 3 A′ HCN and 1 3 A′ HCO + Vibrational Frequencies and Spectroscopic Constants from Quartic Force Fields

✍ Scribed by Fortenberry, Ryan C.; Huang, Xinchuan; Crawford, T. Daniel; Lee, Timothy J.


Book ID
126884893
Publisher
American Chemical Society
Year
2012
Tongue
English
Weight
440 KB
Volume
117
Category
Article
ISSN
1089-5639

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A new method based on scaled ab uutio force fields is mtroduced for c$culatrng evcttedstate viiratronal frequencies. Apphcatron to formaldehyde confirms the need to revrse the value of vg (A, HzCO), but not the value of va(z DaCO). Lasers have revolutiomzed electronic spectroscopy and photochemistr