Journal
NANO LETTERS
Volume 8, Issue 10, Pages 3166-3170Publisher
AMER CHEMICAL SOC
DOI: 10.1021/nl801417w
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Funding
- Greek government [PENED2003 03ED548]
- Greek Ministry of Development-General Secretariat of Research and Technology
- Interreg IIIA Greece - Cyprus collaboration [K2301.004]
- European Commission [SES6-518271]
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A multiscale theoretical approach was used to investigate hydrogen storage in a novel three-dimensional carbon nanostructure. This novel nanoporous material has by design tunable pore sizes and surface areas. Its interaction with hydrogen was studied thoroughly via ab initio and grand canonical Monte Carlo calculations. Our results show that, if this material is doped with lithium cations, it can store up to 41 g H-2/L under ambient conditions, almost reaching the DOE volumetric requirement for mobile applications.
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