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Bhawna Bhatia, Ph.D.

Affiliations: 
2006 Carnegie Mellon University, Pittsburgh, PA 
Area:
Transport Through Nanoporous Materials, Chiral Surface Chemistry
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"Bhawna Bhatia"
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David S. Sholl grad student 2006 Carnegie Mellon
 (Enantiospecific interactions of chiral molecules with intrinsically chiral copper surfaces.)

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Publications

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Bhatia B, Sholl DS. (2008) Characterization of enantiospecific chemisorption on chiral Cu surfaces vicinal to Cu(111) and Cu(100) using density functional theory. The Journal of Chemical Physics. 128: 144709
Bhatia B, Sholl DS. (2005) Enantiospecific chemisorption of small molecules on intrinsically chiral Cu surfaces. Angewandte Chemie (International Ed. in English). 44: 7761-4
Bhatia B, Sholl DS. (2005) Chemisorption and diffusion of hydrogen on surface and subsurface sites of flat and stepped nickel surfaces. The Journal of Chemical Physics. 122: 204707
Bhatia B, Sholl DS. (2005) Quantitative assessment of hydrogen diffusion by activated hopping and quantum tunneling in ordered intermetallics Physical Review B - Condensed Matter and Materials Physics. 72
Bhatia B, Sholl D. (2005) Predicting hydrogen diffusion rates by activated hopping and quantum tunneling in complex metallic structures Acs National Meeting Book of Abstracts. 230
Bhatia B, Kamakoti P, Sholl DS. (2005) Predicting hydrogen diffusion rates by activated hopping and quantum tunneling in complex metallic structures Acs Division of Fuel Chemistry, Preprints. 50: 548-549
Li T, Bhatia B, Sholl DS. (2004) First-principles study of C adsorption, O adsorption, and CO dissociation on flat and stepped Ni surfaces. The Journal of Chemical Physics. 121: 10241-9
Bhatia B, Luo X, Sholl CA, et al. (2004) Diffusion of hydrogen in cubic Laves phase HfTi2Hx Journal of Physics Condensed Matter. 16: 8891-8903
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