Yu-ya Ohnishi

Education

Ph.D. (2009) Kyoto University, Japan (Molecular Engineering, Engineering)
M.S. (2006) Kyoto University, Japan (Molecular Engineering, Engineering)
B.S. (2004) Kyoto University, Japan (Molecular Engineering, Engineering)

Professional Experience

Assistant Professor, Graduate School of System Informatics, Kobe Univ, July 2013 - Present
Assistant Professor extraordinary, Graduate School of System Informatics, Kobe Univ, September 2011 - June 2013
Postdoctoral Research Associate, Department of Chemistry, University of Illinois at Urbana-Champaign with Professor So Hirata, September 2010 - August 2011
Postdoctoral Research Associate, Department of Chemistry, Florida University with Associate Professor So Hirata, September 2009 - August 2010
Postdoctoral Research Associate, Graduate School of Engineering with Professor Shigeyoshi Sakaki, April 2009 - August 2009

Fellowship

JSPS Fellow, DC1
Japan Society for the Promotion of Science, 2006-2009.

Area of Specialization

  1. Quantum Chemistry
  2. Molecular Electronic Structure
  3. Organometallic chemistry

Selected papers

“Theoretical Study of Oxidative Additions of H2 and MeCN to a Nickel(0) Complex: Significantly Large Correlation Effects and Characteristic Features of the Reaction”, Y.-y. Ohnishi, N. Nakao, H. Sato, S. Sakaki, J. Phys. Chem. A 111 7915-7924 (2007)
“Frontier Orbital Consistent Quantum Capping Potential (FOC-QCP) for Bulky Ligand of Transition Metal Complexes”, Y.-y. Ohnishi, N. Nakao, H. Sato, S. Sakaki, J. Phys. Chem. A 112 1946-1955 (2008)
“Logarithm second-order many-body perturbation method for extended systems”, Y.-y. Ohnishi and S. Hirata, J. Chem. Phys. 133 034106 (2010)
“Interaction Energy of Large Molecules from Restrained Denominator MP2-F12”, Y.-y. Ohnishi and S. Ten-no, J. Chem. Theory Comput. 10 4857 (2014)

Link

Personal website
(Full publication list)