|
Eur. J. Mass Spectrom. 1, 499 - 500 (1995) |
|
Comment: On the relative heats of formation of C3H7O+ ions. An ab initio molecular orbital [G2(MP2) and CBS-Q] study | ||
Peter E. Andersen and Steen Hammerum |
||
ABSTRACT: | ||
The heats of formation of the four C3H7O+ ions have been calculated using the G2(MP2) and CBS-Q theoretical procedures, to resolve a discrepancy between experimentally determined values. | ||
Keywords: |
You can now buy this paper on-line in PDF format; it costs only £11.75. Just click on the BUY on-line button. You can pay on-line through a secure server and get access immediately.
© IM Publications
Any problems? E-mail .