Dissociation of Water on Defective Carbon Substrates

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Article on the dissociation of water on defective carbon substrates.

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4 p.: ill.

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Kostov, Milen; Santiso, Erik; George, A. M.; Gubbins, Keith E. & Buongiorno Nardelli, Marco September 23, 2005.

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Article on the dissociation of water on defective carbon substrates.

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4 p.: ill.

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Copyright 2005 American Physical Society. The following article appeared in Physical Review Letters, 95:13, http://link.aps.org/doi/10.1103/PhysRevLett.95.136105

Abstract: Using calculations from first principles, we found that water can dissociate over defective sites in graphene or nanotubes following many possible reaction pathways, some of which have activation barriers lower than half the value for the dissociation of bulk water. This reduction is caused by spin selection rules that allow the system to remain on the same spin surface throughout the reaction.

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  • Physical Review Letters, 2005, College Park: American Physical Society

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  • Publication Title: Physical Review Letters
  • Volume: 95
  • Issue: 13
  • Peer Reviewed: Yes

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  • September 23, 2005

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  • Jan. 21, 2014, 10:26 a.m.

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  • March 27, 2014, 4:17 p.m.

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Kostov, Milen; Santiso, Erik; George, A. M.; Gubbins, Keith E. & Buongiorno Nardelli, Marco. Dissociation of Water on Defective Carbon Substrates, article, September 23, 2005; [College Park, Maryland]. (digital.library.unt.edu/ark:/67531/metadc270782/: accessed November 20, 2018), University of North Texas Libraries, Digital Library, digital.library.unt.edu; crediting UNT College of Arts and Sciences.