Group Additivity and Modified Linear Scaling Relations for Estimating Surface Thermochemistry on Transition Metal Surfaces: Application to Furanics

Vorotnikov, V.; Vlachos, D. G.

doi:10.1021/acs.jpcc.5b01696

Title: Group Additivity and Modified Linear Scaling Relations for Estimating Surface Thermochemistry on Transition Metal Surfaces: Application to Furanics

Journal Article · Thu May 14 00:00:00 EDT 2015 · J. Phys. Chem. C

DOI:https://doi.org/10.1021/acs.jpcc.5b01696· OSTI ID:1210679

Vorotnikov, V.; Vlachos, D. G.

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Research Organization:: Energy Frontier Research Centers (EFRC) (United States). Catalysis Center for Energy Innovation (CCEI)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

DOE Contract Number:: SC0001004

OSTI ID:: 1210679

Journal Information:: J. Phys. Chem. C, Related Information: CCEI partners with the University of Delaware (lead); Brookhaven National Laboratory; California Institute of Technology; Columbia University; University of Delaware; Lehigh University; University of Massachusetts, Amherst; Massachusetts Institute of Technology; University of Minnesota; Pacific Northwest National Laboratory; University of Pennsylvania; Princeton University; Rutgers University

Country of Publication:: United States

Language:: English

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Title: Group Additivity and Modified Linear Scaling Relations for Estimating Surface Thermochemistry on Transition Metal Surfaces: Application to Furanics

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