1. BulletNeil Qiang Su and Xin Xu*, Development of New Density Functional Approximations, Annu. Rev. Phys. Chem. 2017. 68:8.1–8.28


  1. BulletNeil Qiang Su and Xin Xu*, When does a functional correctly describe both the structure and the energy of the transition state? J. Mol. Model., 2017, 23, 65


  1. BulletDongxia Ma, Congjie Zhang*, Zhe-Ning Chen and Xin Xu*, Rational design of model Pd(II)-catalysts for C–H activation involving ligands with charge-shift bonding characteristics, Phys. Chem. Chem. Phys., 2017, 19, 2417

 
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