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The Journal of Chemical Physics|July 28, 2007
Assessment and formal properties of exchange-correlation functionals constructed from the adiabatic connectionAron J Cohen, Paula Mori-Sánchez, Weitao Yang
The Journal of Chemical Physics|March 11, 2006
Self-interaction-free exchange-correlation functional for thermochemistry and kineticsPaula Mori-Sánchez, Aron J Cohen, Weitao Yang
Journal of Chemical Theory and Computation|July 30, 2013
Noncovalent Interaction Analysis in Fluctuating EnvironmentsPan Wu, Robin Chaudret, Xiangqian Hu, et al.
The Journal of Chemical Physics|May 20, 2006
Nanotube-metal junctions: 2- and 3-terminal electrical transportSan-Huang Ke, Weitao Yang, Harold U Baranger
ACS Nano|February 3, 2015
Direct observation of multimer stabilization in the mechanical unfolding pathway of a protein undergoing oligomerizationZackary N Scholl, Weitao Yang, Piotr E Marszalek
The Journal of Physical Chemistry. A|September 11, 2023
Linear Scaling Calculations of Excitation Energies with Active-Space Particle-Particle Random-Phase ApproximationJiachen Li, Jincheng Yu, Zehua Chen, et al.
Physical Review Letters|October 4, 2003
Addition energies of fullerenes and carbon nanotubes as quantum dots: the role of symmetrySan-Huang Ke, Harold U Baranger, Weitao Yang
The Journal of Physical Chemistry Letters|June 26, 2018
Single, Double Electronic Excitations and Exciton Effective Conjugation Lengths in π-Conjugated SystemsChristopher Sutton, Yang Yang, Du Zhang, et al.
The Journal of Chemical Physics|October 16, 2007
Electron transport through single conjugated organic molecules: basis set effects in ab initio calculationsSan-Huang Ke, Harold U Baranger, Weitao Yang
The Journal of Chemical Physics|January 6, 2006
Models of electrodes and contacts in molecular electronicsSan-Huang Ke, Harold U Baranger, Weitao Yang
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