Please use this identifier to cite or link to this item:
https://olympias.lib.uoi.gr/jspui/handle/123456789/8534| Title: | Morate - a Program for Direct Dynamics Calculations of Chemical-Reaction Rates by Semiempirical Molecular-Orbital Theory |
| Institution and School/Department of submitter: | Πανεπιστήμιο Ιωαννίνων. Σχολή Θετικών Επιστημών. Τμήμα Χημείας |
| Keywords: | transition-state theory,intrinsic reaction coordinate,canonical variational theory,classical mechanical theory,potential-energy surface,collinear reactions,tunneling calculations,polyatomic-molecules,hydrogen molecules,reaction paths |
| URI: | https://olympias.lib.uoi.gr/jspui/handle/123456789/8534 |
| ISSN: | 0010-4655 |
| Link: | <Go to ISI>://A1993KV57700013 http://ac.els-cdn.com/0010465593901729/1-s2.0-0010465593901729-main.pdf?_tid=6386d6b2-3581-11e3-a387-00000aacb362&acdnat=1381831738_ad7f52f644e7c54bf2a910deb7e38185 |
| Publisher: | Elsevier |
| Appears in Collections: | Άρθρα σε επιστημονικά περιοδικά ( Ανοικτά). ΧΗΜ |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| Truong-1993-Morate - a Program f.pdf | 1.56 MB | Adobe PDF | View/Open Request a copy |
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