Voltage clustering in redox-active ligand complexes: mitigating electronic communication through choice of metal ion
Abstract
We used the redox-active bis(imino)acenapthene (BIAN) ligand to synthesize homoleptic aluminum, chromium, and gallium complexes of the general formula (BIAN)3M. The resulting compounds were characterized using X-ray crystallography, NMR, EPR, magnetic susceptibility and cyclic voltammetry measurements and modeled using both DFT and ab initio wavefunction calculations to compare the orbital contributions of main group elements and transition metals in ligand-based redox events. Ultimately, complexes of this type have the potential to improve the energy density and electrolyte stability of grid-scale energy storage technologies, such as redox flow batteries, through thermodynamically-clustered redox events.
- Authors:
-
- Sandia National Lab. (SNL-CA), Livermore, CA (United States)
- San Francisco State Univ., CA (United States)
- Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
- Univ. of Pennsylvania, Philadelphia, PA (United States)
- Sandia National Lab. (SNL-CA), Livermore, CA (United States); Davidson College, Davidson, NC (United States)
- Publication Date:
- Research Org.:
- Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Sandia National Lab. (SNL-CA), Livermore, CA (United States)
- Sponsoring Org.:
- USDOE Office of Electricity (OE), Advanced Grid Research & Development. Power Systems Engineering Research
- OSTI Identifier:
- 1249077
- Report Number(s):
- SAND2016-0959J
Journal ID: ISSN 1477-9226; ICHBD9; 619086
- Grant/Contract Number:
- AC04-94AL85000
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Dalton Transactions
- Additional Journal Information:
- Journal Volume: 7; Journal Issue: C; Journal ID: ISSN 1477-9226
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 25 ENERGY STORAGE
Citation Formats
Zarkesh, Ryan A., Ichimura, Andrew S., Monson, Todd C., Tomson, Neil C., and Anstey, Mitchell R. Voltage clustering in redox-active ligand complexes: mitigating electronic communication through choice of metal ion. United States: N. p., 2016.
Web. doi:10.1039/c6dt00422a.
Zarkesh, Ryan A., Ichimura, Andrew S., Monson, Todd C., Tomson, Neil C., & Anstey, Mitchell R. Voltage clustering in redox-active ligand complexes: mitigating electronic communication through choice of metal ion. United States. https://doi.org/10.1039/c6dt00422a
Zarkesh, Ryan A., Ichimura, Andrew S., Monson, Todd C., Tomson, Neil C., and Anstey, Mitchell R. Mon .
"Voltage clustering in redox-active ligand complexes: mitigating electronic communication through choice of metal ion". United States. https://doi.org/10.1039/c6dt00422a. https://www.osti.gov/servlets/purl/1249077.
@article{osti_1249077,
title = {Voltage clustering in redox-active ligand complexes: mitigating electronic communication through choice of metal ion},
author = {Zarkesh, Ryan A. and Ichimura, Andrew S. and Monson, Todd C. and Tomson, Neil C. and Anstey, Mitchell R.},
abstractNote = {We used the redox-active bis(imino)acenapthene (BIAN) ligand to synthesize homoleptic aluminum, chromium, and gallium complexes of the general formula (BIAN)3M. The resulting compounds were characterized using X-ray crystallography, NMR, EPR, magnetic susceptibility and cyclic voltammetry measurements and modeled using both DFT and ab initio wavefunction calculations to compare the orbital contributions of main group elements and transition metals in ligand-based redox events. Ultimately, complexes of this type have the potential to improve the energy density and electrolyte stability of grid-scale energy storage technologies, such as redox flow batteries, through thermodynamically-clustered redox events.},
doi = {10.1039/c6dt00422a},
journal = {Dalton Transactions},
number = C,
volume = 7,
place = {United States},
year = {Mon Feb 01 00:00:00 EST 2016},
month = {Mon Feb 01 00:00:00 EST 2016}
}
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