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This content will become publicly available on March 17, 2020

Title: Multi‐electron Reduction Capacity and Multiple Binding Pockets in Metal–Organic Redox Assembly at Surfaces

Authors:
ORCiD logo [1] ; ORCiD logo [1] ; ORCiD logo [2] ; ORCiD logo [3] ;  [1] ; ORCiD logo [4] ;  [1] ; ORCiD logo [4] ; ORCiD logo [1] ; ORCiD logo [4] ; ORCiD logo [1] ; ORCiD logo [5]
  1. Departments of ChemistryIndiana University Bloomington IN 47401 USA
  2. Department of PhysicsIndiana University Bloomington IN 47401 USA
  3. Departments of ChemistryIndiana University Bloomington IN 47401 USA, NAVSEA Crane Crane IN 47522 USA
  4. Department of PhysicsUniversity of Central Florida Orlando FL USA
  5. Departments of ChemistryIndiana University Bloomington IN 47401 USA, Department of PhysicsIndiana University Bloomington IN 47401 USA
Publication Date:
Grant/Contract Number:
SC0016367
Type:
Publisher's Accepted Manuscript
Journal Name:
Chemistry - A European Journal
Additional Journal Information:
Journal Name: Chemistry - A European Journal Journal Volume: 25 Journal Issue: 21; Journal ID: ISSN 0947-6539
Publisher:
Wiley Blackwell (John Wiley & Sons)
Sponsoring Org:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Country of Publication:
Germany
Language:
English
OSTI Identifier:
1501742

Morris, Tobias W., Huerfano, I. J., Wang, Miao, Wisman, David L., Cabelof, Alyssa C., Din, Naseem U., Tempas, Christopher D., Le, Duy, Polezhaev, Alexander V., Rahman, Talat S., Caulton, Kenneth G., and Tait, Steven L.. Multi‐electron Reduction Capacity and Multiple Binding Pockets in Metal–Organic Redox Assembly at Surfaces. Germany: N. p., Web. doi:10.1002/chem.201900002.
Morris, Tobias W., Huerfano, I. J., Wang, Miao, Wisman, David L., Cabelof, Alyssa C., Din, Naseem U., Tempas, Christopher D., Le, Duy, Polezhaev, Alexander V., Rahman, Talat S., Caulton, Kenneth G., & Tait, Steven L.. Multi‐electron Reduction Capacity and Multiple Binding Pockets in Metal–Organic Redox Assembly at Surfaces. Germany. doi:10.1002/chem.201900002.
Morris, Tobias W., Huerfano, I. J., Wang, Miao, Wisman, David L., Cabelof, Alyssa C., Din, Naseem U., Tempas, Christopher D., Le, Duy, Polezhaev, Alexander V., Rahman, Talat S., Caulton, Kenneth G., and Tait, Steven L.. 2019. "Multi‐electron Reduction Capacity and Multiple Binding Pockets in Metal–Organic Redox Assembly at Surfaces". Germany. doi:10.1002/chem.201900002.
@article{osti_1501742,
title = {Multi‐electron Reduction Capacity and Multiple Binding Pockets in Metal–Organic Redox Assembly at Surfaces},
author = {Morris, Tobias W. and Huerfano, I. J. and Wang, Miao and Wisman, David L. and Cabelof, Alyssa C. and Din, Naseem U. and Tempas, Christopher D. and Le, Duy and Polezhaev, Alexander V. and Rahman, Talat S. and Caulton, Kenneth G. and Tait, Steven L.},
abstractNote = {},
doi = {10.1002/chem.201900002},
journal = {Chemistry - A European Journal},
number = 21,
volume = 25,
place = {Germany},
year = {2019},
month = {3}
}

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From ultrasoft pseudopotentials to the projector augmented-wave method
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Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
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Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
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