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Title: Development of a ReaxFF Reactive Force Field for Tetrabutylphophonium Glycinate/CO2 Mixtures

Journal Article · · J Phys Chem B
DOI:https://doi.org/10.1021/jp5054277· OSTI ID:1168041

Research Organization:
Energy Frontier Research Centers (EFRC) (United States). Fluid Interface Reactions, Structures and Transport Center (FIRST)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
DOE Contract Number:
ERKCC61
OSTI ID:
1168041
Journal Information:
J Phys Chem B, Related Information: FIRST partners with Oak Ridge National Laboratory (lead); Argonne National Laboratory; Drexel University; Georgia State University; Northwestern University; Pennsylvania State University; Suffolk University; Vanderbilt University; University of Virginia
Country of Publication:
United States
Language:
English

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