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THE JOURNAL OF CHEMICAL PHYSICS 134, 134701 (2011) Binding of hydrogen on benzene, coronene, and graphene from quantum
 

Summary: THE JOURNAL OF CHEMICAL PHYSICS 134, 134701 (2011)
Binding of hydrogen on benzene, coronene, and graphene from quantum
Monte Carlo calculations
Jie Ma,1,2,3
Angelos Michaelides,2,3,4
and Dario Alfè3,4,5,6,a)
1
Institute of Physics, Chinese Academy of Sciences, P.O. Box 603, Beijing 100190, China
2
Department of Chemistry, University College London, Gower Street, London WC1E 6BT, United Kingdom
3
London Centre for Nanotechnology, University College London, 17-19 Gordon Street, London WC1H 0AH,
United Kingdom
4
Thomas Young Centre@UCL, University College London, Gower Street, London WC1E 6 BT,
United Kingdom
5
Department of Earth Sciences, University College London, Gower Street, London WC1E 6BT,
United Kingdom
6

  

Source: Alavi, Ali - Department of Chemistry, University of Cambridge
Alfè, Dario - Departments of Earth Sciences & Physics and Astronomy, University College London

 

Collections: Chemistry; Geosciences; Physics