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Journal of Chemical Theory and Computation|November 18, 2015
Excited-State Geometry Optimization with the Density Matrix Renormalization Group, as Applied to PolyenesWeifeng Hu, Garnet Kin-Lic ChanJournal of Chemical Theory and Computation|November 21, 2015
Density Matrix Embedding: A Strong-Coupling Quantum Embedding TheoryGerald Knizia, Garnet Kin-Lic ChanJournal of Chemical Theory and Computation|November 21, 2015
Exact and Optimal Quantum Mechanics/Molecular Mechanics BoundariesQiming Sun, Garnet Kin-Lic ChanPhysical Review Letters|May 21, 2005
Time-dependent density functional theory of classical fluidsGarnet Kin-Lic Chan, Reimar FinkenThe Journal of Chemical Physics|September 22, 2014
Communication: A flexible multi-reference perturbation theory by minimizing the Hylleraas functional with matrix product statesSandeep Sharma, Garnet Kin-Lic ChanThe Journal of Chemical Physics|August 3, 2021
Constructing tensor network influence functionals for general quantum dynamicsErika Ye, Garnet Kin-Lic ChanPhysical Review Letters|December 11, 2012
Density matrix embedding: a simple alternative to dynamical mean-field theoryGerald Knizia, Garnet Kin-Lic ChanJournal of Chemical Theory and Computation|January 15, 2025
Accurate QM/MM Molecular Dynamics for Periodic Systems in GPU4PySCF with Applications to Enzyme CatalysisChenghan Li, Garnet Kin-Lic ChanJournal of Chemical Theory and Computation|September 28, 2018
A Time-Dependent Formulation of Coupled-Cluster Theory for Many-Fermion Systems at Finite TemperatureAlec F White, Garnet Kin-Lic ChanThe Journal of Physical Chemistry Letters|May 16, 2018
The Fate of Atomic Spin in Atomic Scattering off SurfacesJoshua S Kretchmer, Garnet Kin-Lic ChanPageof 29