Impact of intrinsic framework flexibility for selective adsorption of sarin in non-aqueous solvents using metal–organic frameworks
Abstract
We assess the nontrivial deviation in predicting the adsorption selectivity from bulk mixtures of complex molecules using nanoporous adsorbents approximated as rigid and intrinsically flexible.
- Authors:
-
[1];
[1];
[2];
[3];
[3];
[1]
- School of Chemical & Biomolecular Engineering, Georgia Institute of Technology, Atlanta, USA
- Nanoscale Sciences Department, Sandia National Laboratories, Albuquerque, USA
- Geochemistry Department, Sandia National Laboratories, Albuquerque, USA
- Publication Date:
- Sponsoring Org.:
- USDOE
- OSTI Identifier:
- 1603799
- Resource Type:
- Publisher's Accepted Manuscript
- Journal Name:
- Physical Chemistry Chemical Physics. PCCP
- Additional Journal Information:
- Journal Name: Physical Chemistry Chemical Physics. PCCP Journal Volume: 22 Journal Issue: 11; Journal ID: ISSN 1463-9076
- Publisher:
- Royal Society of Chemistry (RSC)
- Country of Publication:
- United Kingdom
- Language:
- English
Citation Formats
Park, Jongwoo, Agrawal, Mayank, Sava Gallis, Dorina F., Harvey, Jacob A., Greathouse, Jeffery A., and Sholl, David S. Impact of intrinsic framework flexibility for selective adsorption of sarin in non-aqueous solvents using metal–organic frameworks. United Kingdom: N. p., 2020.
Web. doi:10.1039/C9CP06788D.
Park, Jongwoo, Agrawal, Mayank, Sava Gallis, Dorina F., Harvey, Jacob A., Greathouse, Jeffery A., & Sholl, David S. Impact of intrinsic framework flexibility for selective adsorption of sarin in non-aqueous solvents using metal–organic frameworks. United Kingdom. https://doi.org/10.1039/C9CP06788D
Park, Jongwoo, Agrawal, Mayank, Sava Gallis, Dorina F., Harvey, Jacob A., Greathouse, Jeffery A., and Sholl, David S. Wed .
"Impact of intrinsic framework flexibility for selective adsorption of sarin in non-aqueous solvents using metal–organic frameworks". United Kingdom. https://doi.org/10.1039/C9CP06788D.
@article{osti_1603799,
title = {Impact of intrinsic framework flexibility for selective adsorption of sarin in non-aqueous solvents using metal–organic frameworks},
author = {Park, Jongwoo and Agrawal, Mayank and Sava Gallis, Dorina F. and Harvey, Jacob A. and Greathouse, Jeffery A. and Sholl, David S.},
abstractNote = {We assess the nontrivial deviation in predicting the adsorption selectivity from bulk mixtures of complex molecules using nanoporous adsorbents approximated as rigid and intrinsically flexible.},
doi = {10.1039/C9CP06788D},
journal = {Physical Chemistry Chemical Physics. PCCP},
number = 11,
volume = 22,
place = {United Kingdom},
year = {2020},
month = {3}
}
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