First-principles study of molecular hydrogen dissociation on doped Al::12::X (X = B, Al, C, Si, P, Mg, and Ca) clusters

Lu Wang, Jijun Zhao, Zhen Zhou, S. B. Zhang, Zhongfang Chen. First-principles study of molecular hydrogen dissociation on doped Al::12::X (X = B, Al, C, Si, P, Mg, and Ca) clusters. Journal of Computational Chemistry, 30(15):2509-2514, 2009. [doi]

@article{WangZZZC09,
  title = {First-principles study of molecular hydrogen dissociation on doped Al::12::X (X = B, Al, C, Si, P, Mg, and Ca) clusters},
  author = {Lu Wang and Jijun Zhao and Zhen Zhou and S. B. Zhang and Zhongfang Chen},
  year = {2009},
  doi = {10.1002/jcc.21239},
  url = {http://dx.doi.org/10.1002/jcc.21239},
  tags = {principles, C++},
  researchr = {https://researchr.org/publication/WangZZZC09},
  cites = {0},
  citedby = {0},
  journal = {Journal of Computational Chemistry},
  volume = {30},
  number = {15},
  pages = {2509-2514},
}