Xiaojing Wu

Composition-Dependent Light-Induced Dipole Moment Change in Organometal Halide Perovskites

Linkai Li, Haihua Xu, Ni Zhao, 2015 .

High-performance planar heterojunction perovskite solar cells: Preserving long charge carrier diffusion lengths and interfacial engineering

Tao Song, Ruiyuan Liu, Ni Zhao, 2014, Nano Research.

AMOEBA Polarizable Force Field Parameters of the Heme Cofactor in Its Ferrous and Ferric Forms.

Jean-Philip Piquemal, Louis Lagardère, J. Piquemal, 2018, Journal of chemical theory and computation.

Electronic Coupling Calculations for Bridge-Mediated Charge Transfer Using Constrained Density Functional Theory (CDFT) and Effective Hamiltonian Approaches at the Density Functional Theory (DFT) and Fragment-Orbital Density Functional Tight Binding (FODFTB) Level.

Jochen Blumberger, Marcus Elstner, Natacha Gillet, 2016, Journal of chemical theory and computation.