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Title: Probing the mechanism of CO 2 capture in diamine-appended metal–organic frameworks using measured and simulated X-ray spectroscopy

Abstract

In situX-ray absorption spectroscopy, coupled with DFT calculations, uncovers the details of the novel mechanism for CO 2adsorption in diamine-appended metal–organic frameworks.

Authors:
 [1];  [2];  [3];  [4];  [4];  [4];  [5];  [6];  [4];  [7];  [4];  [1]
  1. Materials Sciences Division; Lawrence Berkeley National Laboratory; Berkeley; USA
  2. Université Grenoble Alpes; Science et Ingénierie des Matériaux et Procédés (SIMAP); F-38000 Grenoble; France
  3. Department of Chemistry; University of California; Berkeley; USA
  4. Molecular Foundry; Lawrence Berkeley National Laboratory; Berkeley; USA
  5. Department of Chemical and Biological Engineering; University of California; Berkeley; USA
  6. Department of Chemistry; Chemical Theory Center and Supercomputing Institute; University of Minnesota; Minneapolis; USA
  7. Materials Sciences Division; Lawrence Berkeley National Laboratory; Berkeley; USA; Department of Chemistry
Publication Date:
Research Org.:
Energy Frontier Research Centers (EFRC) (United States). Center for Gas Separations Relevant to Clean Energy Technologies (CGS)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1386058
DOE Contract Number:  
SC0001015
Resource Type:
Journal Article
Journal Name:
Physical Chemistry Chemical Physics. PCCP (Print)
Additional Journal Information:
Journal Volume: 17; Journal Issue: 33; Related Information: CGS partners with University of California, Berkeley; University of California, Davis; Lawrence Berkeley National Laboratory; University of Minnesota; National Energy Technology Laboratory; Texas A&M University; Journal ID: ISSN 1463-9076
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English
Subject:
membrane, carbon capture, materials and chemistry by design, synthesis (novel materials), synthesis (self-assembly), synthesis (scalable processing)

Citation Formats

Drisdell, Walter S., Poloni, Roberta, McDonald, Thomas M., Pascal, Tod A., Wan, Liwen F., Pemmaraju, C. Das, Vlaisavljevich, Bess, Odoh, Samuel O., Neaton, Jeffrey B., Long, Jeffrey R., Prendergast, David, and Kortright, Jeffrey B. Probing the mechanism of CO 2 capture in diamine-appended metal–organic frameworks using measured and simulated X-ray spectroscopy. United States: N. p., 2015. Web. doi:10.1039/c5cp02951a.
Drisdell, Walter S., Poloni, Roberta, McDonald, Thomas M., Pascal, Tod A., Wan, Liwen F., Pemmaraju, C. Das, Vlaisavljevich, Bess, Odoh, Samuel O., Neaton, Jeffrey B., Long, Jeffrey R., Prendergast, David, & Kortright, Jeffrey B. Probing the mechanism of CO 2 capture in diamine-appended metal–organic frameworks using measured and simulated X-ray spectroscopy. United States. doi:10.1039/c5cp02951a.
Drisdell, Walter S., Poloni, Roberta, McDonald, Thomas M., Pascal, Tod A., Wan, Liwen F., Pemmaraju, C. Das, Vlaisavljevich, Bess, Odoh, Samuel O., Neaton, Jeffrey B., Long, Jeffrey R., Prendergast, David, and Kortright, Jeffrey B. Thu . "Probing the mechanism of CO 2 capture in diamine-appended metal–organic frameworks using measured and simulated X-ray spectroscopy". United States. doi:10.1039/c5cp02951a.
@article{osti_1386058,
title = {Probing the mechanism of CO 2 capture in diamine-appended metal–organic frameworks using measured and simulated X-ray spectroscopy},
author = {Drisdell, Walter S. and Poloni, Roberta and McDonald, Thomas M. and Pascal, Tod A. and Wan, Liwen F. and Pemmaraju, C. Das and Vlaisavljevich, Bess and Odoh, Samuel O. and Neaton, Jeffrey B. and Long, Jeffrey R. and Prendergast, David and Kortright, Jeffrey B.},
abstractNote = {In situX-ray absorption spectroscopy, coupled with DFT calculations, uncovers the details of the novel mechanism for CO2adsorption in diamine-appended metal–organic frameworks.},
doi = {10.1039/c5cp02951a},
journal = {Physical Chemistry Chemical Physics. PCCP (Print)},
issn = {1463-9076},
number = 33,
volume = 17,
place = {United States},
year = {2015},
month = {1}
}

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