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Title: Communication: First-principles evaluation of alkali ion adsorption and ion exchange in pure silica LTA zeolite

Authors:
ORCiD logo [1] ;  [2] ;  [2] ;  [1]
  1. Nuclear Engineering Program, University of South Carolina, Columbia, South Carolina 29208, USA
  2. Pacific Northwest National Laboratory, P.O. Box 999, Richland, Washington 99352, USA
Publication Date:
Grant/Contract Number:
SC0016575
Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Name: Journal of Chemical Physics Journal Volume: 149 Journal Issue: 13; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English
OSTI Identifier:
1476130

Kocevski, Vancho, Zeidman, Benjamin D., Henager, Jr., Charles H., and Besmann, Theodore M.. Communication: First-principles evaluation of alkali ion adsorption and ion exchange in pure silica LTA zeolite. United States: N. p., Web. doi:10.1063/1.5051347.
Kocevski, Vancho, Zeidman, Benjamin D., Henager, Jr., Charles H., & Besmann, Theodore M.. Communication: First-principles evaluation of alkali ion adsorption and ion exchange in pure silica LTA zeolite. United States. doi:10.1063/1.5051347.
Kocevski, Vancho, Zeidman, Benjamin D., Henager, Jr., Charles H., and Besmann, Theodore M.. 2018. "Communication: First-principles evaluation of alkali ion adsorption and ion exchange in pure silica LTA zeolite". United States. doi:10.1063/1.5051347.
@article{osti_1476130,
title = {Communication: First-principles evaluation of alkali ion adsorption and ion exchange in pure silica LTA zeolite},
author = {Kocevski, Vancho and Zeidman, Benjamin D. and Henager, Jr., Charles H. and Besmann, Theodore M.},
abstractNote = {},
doi = {10.1063/1.5051347},
journal = {Journal of Chemical Physics},
number = 13,
volume = 149,
place = {United States},
year = {2018},
month = {10}
}

Works referenced in this record:

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
journal, July 1996