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https://olympias.lib.uoi.gr/jspui/handle/123456789/8702
Title: | Optimized Calculations of Reaction Paths and Reaction-Path Functions for Chemical-Reactions |
Institution and School/Department of submitter: | Πανεπιστήμιο Ιωαννίνων. Σχολή Θετικών Επιστημών. Τμήμα Χημείας |
Keywords: | transition-state-theory,intrinsic reaction coordinate,semiclassical tunneling calculations,ordinary differential equations,potential-energy surface,collinear reactions,hydrogen molecules,steepest descent,reaction rates,approximation |
URI: | https://olympias.lib.uoi.gr/jspui/handle/123456789/8702 |
ISSN: | 0021-9606 |
Link: | <Go to ISI>://A1992HN26800022 |
Publisher: | American Institute of Physics (AIP) |
Appears in Collections: | Άρθρα σε επιστημονικά περιοδικά ( Ανοικτά). ΧΗΜ |
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