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Title: Wave Packet Based Statistical Approach to Complex-Forming Reactions

Technical Report ·
DOI:https://doi.org/10.2172/1411428· OSTI ID:1411428
 [1]
  1. Univ. of New Mexico, Albuquerque, NM (United States). Dept. of Chemistry and Chemical Biology

Combustion represents a key chemical process in energy consumption in modern societies and a clear and comprehensive understanding of the elemental reactions in combustion is of great importance to a number of challenging areas such as engine efficiency and environmental protection. In this award, we proposed to develop new theoretical tools to understand elemental chemical processes in combustion environments. With the support of this DOE grant, we have made significant advances in developing new and more efficient and accurate algorithms to characterize reaction dynamics.

Research Organization:
Univ. of New Mexico, Albuquerque, NM (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences, and Biosciences Division
DOE Contract Number:
FG02-05ER15694
OSTI ID:
1411428
Report Number(s):
DOE-UNM-ER-15694
Country of Publication:
United States
Language:
English