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Title: Computational Screening of Nanoporous Materials for Hexane and Heptane Isomer Separation

Authors:
ORCiD logo [1]; ORCiD logo;  [2]; ; ; ; ORCiD logo;  [3]; ORCiD logo [4]; ORCiD logo [5]; ORCiD logo [6]; ORCiD logo; ORCiD logo
  1. School of Chemical and Biomolecular Engineering, Pusan National University, 46241 Busan, South Korea
  2. Computational Research Division, Lawrence Berkeley National Laboratory, One Cyclotron Road, MS 50F-1650, Berkeley, California 94720, United States
  3. Department of Chemical Engineering, Vrije Universiteit Brussel, Pleinlaan 2, 1050 Elsene, Belgium
  4. Robert Frederick Smith School of Chemical and Biomolecular Engineering, Cornell University, Ithaca, New York 14853, United States
  5. Materials Science Division, Argonne National Laboratory, 9700 South Cass Avenue, Argonne, Illinois 60439, United States
  6. Department of Chemistry, Faculty of Science, King Abdulaziz University, Jeddah 22254, Saudi Arabia
Publication Date:
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Northwestern Univ., Evanston, IL (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES); National Research Foundation of Korea (NRF)
OSTI Identifier:
1371787
Alternate Identifier(s):
OSTI ID: 1417602; OSTI ID: 1508070
Grant/Contract Number:  
AC02-06CH11357; FG02-08ER15967; FG02-12ER16362; AC02-05CH11231; NRF-2016R1D1A1B03934484; SC0008688
Resource Type:
Published Article
Journal Name:
Chemistry of Materials
Additional Journal Information:
Journal Name: Chemistry of Materials Journal Volume: 29 Journal Issue: 15; Journal ID: ISSN 0897-4756
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY

Citation Formats

Chung, Yongchul G., Bai, Peng, Haranczyk, Maciej, Leperi, Karson T., Li, Peng, Zhang, Hongda, Wang, Timothy C., Duerinck, Tim, You, Fengqi, Hupp, Joseph T., Farha, Omar K., Siepmann, J. Ilja, and Snurr, Randall Q. Computational Screening of Nanoporous Materials for Hexane and Heptane Isomer Separation. United States: N. p., 2017. Web. doi:10.1021/acs.chemmater.7b01565.
Chung, Yongchul G., Bai, Peng, Haranczyk, Maciej, Leperi, Karson T., Li, Peng, Zhang, Hongda, Wang, Timothy C., Duerinck, Tim, You, Fengqi, Hupp, Joseph T., Farha, Omar K., Siepmann, J. Ilja, & Snurr, Randall Q. Computational Screening of Nanoporous Materials for Hexane and Heptane Isomer Separation. United States. doi:10.1021/acs.chemmater.7b01565.
Chung, Yongchul G., Bai, Peng, Haranczyk, Maciej, Leperi, Karson T., Li, Peng, Zhang, Hongda, Wang, Timothy C., Duerinck, Tim, You, Fengqi, Hupp, Joseph T., Farha, Omar K., Siepmann, J. Ilja, and Snurr, Randall Q. Wed . "Computational Screening of Nanoporous Materials for Hexane and Heptane Isomer Separation". United States. doi:10.1021/acs.chemmater.7b01565.
@article{osti_1371787,
title = {Computational Screening of Nanoporous Materials for Hexane and Heptane Isomer Separation},
author = {Chung, Yongchul G. and Bai, Peng and Haranczyk, Maciej and Leperi, Karson T. and Li, Peng and Zhang, Hongda and Wang, Timothy C. and Duerinck, Tim and You, Fengqi and Hupp, Joseph T. and Farha, Omar K. and Siepmann, J. Ilja and Snurr, Randall Q.},
abstractNote = {},
doi = {10.1021/acs.chemmater.7b01565},
journal = {Chemistry of Materials},
number = 15,
volume = 29,
place = {United States},
year = {2017},
month = {7}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1021/acs.chemmater.7b01565

Citation Metrics:
Cited by: 7 works
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Works referencing / citing this record:

Topologically guided tuning of Zr-MOF pore structures for highly selective separation of C6 alkane isomers
journal, May 2018


Topologically guided tuning of Zr-MOF pore structures for highly selective separation of C6 alkane isomers
journal, May 2018