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  Dr. JAMES MAO  
 
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Title : Dr.
First Name : JAMES
Last Name : MAO
University/Institution : University of Pittsburgh
Email ID : xjamesmao@gmail.com
City : Pittsburgh
Country : United States
State : Pennsylvania
Zipcode : 15204
Department : Department of Chemistry
Company Name :
Area of Research
Computational Chemistry
Area of Expertise
Theoretical Chemistry
Brief Description of Research Interest :
ab initio calculations; molecular dynamic calculations;
Representative Publications :
1. Mao, James X.; Nulwala, Hunaid B.; Luebke, David R.; et al. (2012) "Spectroscopic and computational analysis of the molecular interactions in the ionic liquid ion pair [BMP](+)[TFSI](-)" JOURNAL OF MOLECULAR LIQUIDS 175:141-147

2. Mao, James X.; Lee, Anita S.; Kitchin, John R.; et al. (2013) "Interactions in 1-ethyl-3-methyl imidazolium tetracyanoborate ion pair: Spectroscopic and density functional study" JOURNAL OF MOLECULAR STRUCTURE 1038:12-18

3. Mao, James X.; Mathers, Robert T.; Damodaran, Krishnan (2013) "NMR spectroscopic and computational investigations of RuHCl(CO)(PPh3)(3) catalyzed isomerization of 1,4-cyclohexadiene" JOURNAL OF ORGANOMETALLIC CHEMISTRY 741:15-19

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