Publikationen von Jingjing Zheng

Zeitschriftenartikel (4)

Marquardt, R.; Sagui, K.; Zheng, J.; Thiel, W.; Luckhaus, D.; Yurchenko, S.; Mariotti, F.; Quack, M. Global Analytical Potential Energy Surface for the Electronic Ground State of NH3 from High Level ab Initio Calculations. The Journal of Physical Chemistry A 2013, 117, 7502–7522.
Wang, D.; Zheng, J. J.; Shaik, S.; Thiel, W. Quantum and molecular mechanical study of the first proton transfer in the catalytic cycle of cytochrome p450cam and its mutant D251N. Journal of Physical Chemistry B 2008, 112, 5126–5138.
Zheng, J. J.; Altun, A.; Thiel, W. Common system setup for the entire catalytic cycle of cytochrome P450cam in quantum mechanical/molecular mechanical studies. Journal of Computational Chemistry 2007, 28, 2147–2158.
Yurchenko, S. N.; Carvajal, M.; Jensen, P.; Lin, H.; Zheng, J. J.; Thiel, W. Rotation-vibration motion of pyramidal XY₃ molecules described in the Eckart frame: Theory and application to NH₃. Molecular Physics 2005, 103, 359–378.
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