Zhi Wang, Ph.D.

Affiliations: 
Chemistry Emory University, Atlanta, GA 
Area:
Theoretical Chemistry
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"Zhi Wang"
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Keiji Morokuma grad student 2008 Emory
 (Quantum mechanical study of molecular processes: From gas phase to nano phase.)
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Publications

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Zhang Y, Yu C, Zhou M, et al. (2015) Complete Genome Sequence of Rufibacter tibetensis Strain 1351, a Radiation-resistant Bacterium from Tibet plateau. Journal of Biotechnology
Nishimoto Y, Wang Z, Morokuma K, et al. (2012) Molecular and electronic structures of endohedral fullerenes, Sc 2C 2@C 3v-C 82 and Sc 2@C 3v-C 82: Benchmark for SCC-DFTB and proposal of new inner cluster structures Physica Status Solidi (B) Basic Research. 249: 324-334
Wang Z, Kerkines IS, Morokuma K, et al. (2009) Analytical potential energy surfaces for N(3) low-lying doublet states. The Journal of Chemical Physics. 130: 044313
Kerkines IS, Wang Z, Zhang P, et al. (2009) Structures and energies of low-lying doublet excited states of N3 from accurate configuration interaction calculations Molecular Physics. 107: 1017-1025
Kerkines IS, Wang Z, Zhang P, et al. (2008) Photodissociation of ClN(3) at 157 nm: Theory suggests a pathway leading to cyclic N(3). The Journal of Chemical Physics. 129: 171101
Wang Z, Irle S, Zheng G, et al. (2008) Analysis of the Relationship between Reaction Energies of Electrophilic SWNT Additions and Sidewall Curvature: Chiral Nanotubes The Journal of Physical Chemistry C. 112: 12697-12705
Zheng G, Wang Z, Irle S, et al. (2007) Quantum chemical molecular dynamics study of "shrinking" of hot giant fullerenes. Journal of Nanoscience and Nanotechnology. 7: 1662-9
IRLE S, ZHENG G, WANG Z, et al. (2007) THEORY–EXPERIMENT RELATIONSHIP OF THE "SHRINKING HOT GIANT" ROAD OF DYNAMIC FULLERENE SELF-ASSEMBLY IN HOT CARBON VAPOR Nano. 2: 21-30
Wang Z, Irle S, Zheng G, et al. (2007) Carbon Nanotubes Grow on the C Face of SiC (0001̄) during Sublimation Decomposition:  Quantum Chemical Molecular Dynamics Simulations The Journal of Physical Chemistry C. 111: 12960-12972
Zheng G, Wang Z, Irle S, et al. (2006) Origin of the linear relationship between CH2/NH/O-SWNT reaction energies and sidewall curvature: armchair nanotubes. Journal of the American Chemical Society. 128: 15117-26
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