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This content will become publicly available on April 11, 2019

Title: Improving accuracy of electrochemical capacitance and solvation energetics in first-principles calculations

Authors:
ORCiD logo [1] ;  [2] ; ORCiD logo [3]
  1. Department of Materials Science and Engineering, Rensselaer Polytechnic Institute, 110 8th St., Troy, New York 12180, USA
  2. Center for Nanoscale Materials, Argonne National Laboratory, 9700 S. Cass Ave., Argonne, Illinois 60439, USA
  3. Material Measurement Laboratory, National Institute of Standards and Technology, 100 Bureau Dr., Gaithersburg, Maryland 20899, USA
Publication Date:
Grant/Contract Number:
AC02-06CH11357
Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 148; Journal Issue: 14; Related Information: CHORUS Timestamp: 2018-04-11 10:58:27; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English
OSTI Identifier:
1432740