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On-line ultrasonic monitoring and modelling of radiation-induced structural changes in polymethyl methacrylate

✍ Scribed by B. Bridge


Publisher
Springer
Year
1993
Tongue
English
Weight
842 KB
Volume
28
Category
Article
ISSN
0022-2461

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## Abstract Potential energy surfaces of the model peptide HCO‐L‐Ala‐NH~2~ were calculated using polarizable continuum model (PCM) for the description of aqueous solution at RHF/3‐21G, RHF/6‐31+G(d), and B3LYP/6‐31+G(d) levels of theory. Energy minima were optimized at all three levels as well as a