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Theoretical characteristics of a graphite ionization chamber filled with carbon dioxide

โœ Scribed by M. Makarewicz; S. Pszona


Publisher
Elsevier Science
Year
1978
Weight
331 KB
Volume
153
Category
Article
ISSN
0029-554X

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โœ Jeffrey P. Jones; Jeffrey L. Urbauer ๐Ÿ“‚ Article ๐Ÿ“… 1991 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 829 KB

Heavy atom and deuterium isotope effects for the hydride transfer from formate to carbon dioxide were determined using MNDO, AMl, and PM3 semiempirical methods and the ab initio RHF/3-21G\*, 3-21 + G , 6-31G\*, and 6-31 + G\* basis sets. Frequencies were also determined for ground state structures u