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The Journal of Chemical Physics|April 8, 2023
Multi-site reaction dynamics through multi-fragment density matrix embeddingChenghan Li, Junjie Yang, Xing Zhang, et al.The Journal of Chemical Physics|January 3, 2020
Exact parameterization of fermionic wave functions via unitary coupled cluster theoryFrancesco A Evangelista, Garnet Kin-Lic Chan, Gustavo E ScuseriaThe Journal of Chemical Physics|July 7, 2025
Quantum many-body linear algebra, Hamiltonian moments, and a coupled-cluster inspired frameworkYuhang Ai, Huanchen Zhai, Johannes Tölle, et al.Nature Chemistry|September 23, 2014
Low-energy spectrum of iron-sulfur clusters directly from many-particle quantum mechanicsSandeep Sharma, Kantharuban Sivalingam, Frank Neese, et al.Chemical Reviews|October 22, 2020
Quantum Algorithms for Quantum Chemistry and Quantum Materials ScienceBela Bauer, Sergey Bravyi, Mario Motta, et al.Physical Review Letters|March 20, 2026
Coupled Lindblad Pseudomode Theory for Simulating Open Quantum SystemsZhen Huang, Gunhee Park, Garnet Kin-Lic Chan, et al.The Journal of Chemical Physics|January 21, 2014
Linear response theory for the density matrix renormalization group: efficient algorithms for strongly correlated excited statesNaoki Nakatani, Sebastian Wouters, Dimitri Van Neck, et al.Journal of Chemical Theory and Computation|June 24, 2020
Minimal Matrix Product States and Generalizations of Mean-Field and Geminal Wave FunctionsHenrik R Larsson, Carlos A Jiménez-Hoyos, Garnet Kin-Lic ChanJournal of Chemical Theory and Computation|February 21, 2017
Gaussian-Based Coupled-Cluster Theory for the Ground-State and Band Structure of SolidsJames McClain, Qiming Sun, Garnet Kin-Lic Chan, et al.The Journal of Chemical Physics|March 25, 2006
Tailored coupled cluster singles and doubles method applied to calculations on molecular structure and harmonic vibrational frequencies of ozoneOsamu Hino, Tomoko Kinoshita, Garnet Kin-Lic Chan, et al.Pageof 14