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Title: Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization

Authors:
; ; ;
Publication Date:
Research Org.:
Energy Frontier Research Centers (EFRC) (United States). Energy Frontier Research Center for Inorganometallic Catalyst Design (ICDC)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1470252
DOE Contract Number:  
SC0012702
Resource Type:
Journal Article
Journal Name:
Journal of Catalysis
Additional Journal Information:
Journal Volume: 360; Journal Issue: C; Related Information: ICDC partners with University of Minnesota(lead); Argonne National Laboratory; Clemson University; Dow Chemical Company; Northwestern University; Pacific Northwest National Laboratory; University of California Davis; University of Washington; Journal ID: ISSN 0021-9517
Publisher:
Elsevier
Country of Publication:
United States
Language:
English
Subject:
catalysis (heterogeneous), materials and chemistry by design, synthesis (novel materials)

Citation Formats

Ye, Jingyun, Gagliardi, Laura, Cramer, Christopher J., and Truhlar, Donald G. Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization. United States: N. p., 2018. Web. doi:10.1016/j.jcat.2017.12.007.
Ye, Jingyun, Gagliardi, Laura, Cramer, Christopher J., & Truhlar, Donald G. Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization. United States. doi:10.1016/j.jcat.2017.12.007.
Ye, Jingyun, Gagliardi, Laura, Cramer, Christopher J., and Truhlar, Donald G. Sun . "Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization". United States. doi:10.1016/j.jcat.2017.12.007.
@article{osti_1470252,
title = {Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization},
author = {Ye, Jingyun and Gagliardi, Laura and Cramer, Christopher J. and Truhlar, Donald G.},
abstractNote = {},
doi = {10.1016/j.jcat.2017.12.007},
journal = {Journal of Catalysis},
issn = {0021-9517},
number = C,
volume = 360,
place = {United States},
year = {2018},
month = {4}
}