<h1>Chan, Garnet</h1>
<h2>Article from <a href="https://authors.library.caltech.edu">CaltechAUTHORS</a></h2>
<ul>
<li>Liu, Wen-Yuan and Du, Si-Jing, el al. (2024) <a href="https://authors.library.caltech.edu/records/xqqhh-hsv16">Tensor Network Computations That Capture Strict Variationality, Volume Law Behavior, and the Efficient Representation of Neural Network States</a>; Physical Review Letters; Vol. 133; No. 26; 260404; <a href="https://doi.org/10.1103/physrevlett.133.260404">10.1103/physrevlett.133.260404</a></li>
<li>Park, Gunhee and Huang, Zhen, el al. (2024) <a href="https://authors.library.caltech.edu/records/03z2y-sy364">Quasi-Lindblad pseudomode theory for open quantum systems</a>; Physical Review B; Vol. 110; No. 19; 195148; <a href="https://doi.org/10.1103/physrevb.110.195148">10.1103/physrevb.110.195148</a></li>
<li>Nguyen, Haimi and Ng, Nathan, el al. (2024) <a href="https://authors.library.caltech.edu/records/knamx-nm798">Correlation functions from tensor network influence functionals: The case of the spin-boson model</a>; The Journal of Chemical Physics; Vol. 161; No. 10; <a href="https://doi.org/10.1063/5.0224880">10.1063/5.0224880</a></li>
<li>Hejazi, Kasra and Motta, Mario, el al. (2024) <a href="https://authors.library.caltech.edu/records/1cdqa-p3g97">Adiabatic quantum imaginary time evolution</a>; Physical Review Research; Vol. 6; No. 3; 033084; <a href="https://doi.org/10.1103/physrevresearch.6.033084">10.1103/physrevresearch.6.033084</a></li>
<li>Zhang, Xing and Li, Chenghan, el al. (2024) <a href="https://authors.library.caltech.edu/records/nwt9h-nr791">Performant automatic differentiation of local coupled cluster theories: Response properties and ab initio molecular dynamics</a>; The Journal of Chemical Physics; Vol. 161; No. 1; 014109; <a href="https://doi.org/10.1063/5.0212274">10.1063/5.0212274</a></li>
<li>Provazza, Justin and Gunst, Klaas, el al. (2024) <a href="https://authors.library.caltech.edu/records/z7ty5-4fy76">Fast Emulation of Fermionic Circuits with Matrix Product States</a>; Journal of Chemical Theory and Computation; Vol. 20; No. 9; 3719-3728; <a href="https://doi.org/10.1021/acs.jctc.4c00200">10.1021/acs.jctc.4c00200</a></li>
<li>Tölle, Johannes and Kin-Lic Chan, Garnet (2024) <a href="https://authors.library.caltech.edu/records/bm4e0-ybb64">AB-G₀W₀: A practical G₀W₀ method without frequency integration based on an auxiliary boson expansion</a>; Journal of Chemical Physics; Vol. 160; No. 16; 164108; <a href="https://doi.org/10.1063/5.0195934">10.1063/5.0195934</a></li>
<li>Begušić, Tomislav and Gray, Johnnie, el al. (2024) <a href="https://authors.library.caltech.edu/records/8vnhh-r4p06">Fast and converged classical simulations of evidence for the utility of quantum computing before fault tolerance</a>; Science Advances; Vol. 10; No. 3; eadk4321; <a href="https://doi.org/10.1126/sciadv.adk4321">10.1126/sciadv.adk4321</a></li>
<li>Gray, Johnnie and Chan, Garnet Kin-Lic (2024) <a href="https://authors.library.caltech.edu/records/n5v94-jm720">Hyperoptimized Approximate Contraction of Tensor Networks with Arbitrary Geometry</a>; Physical Review X; Vol. 14; No. 1; 011009; <a href="https://doi.org/10.1103/physrevx.14.011009">10.1103/physrevx.14.011009</a></li>
<li>Peng, Linqing and Zhang, Xing, el al. (2023) <a href="https://authors.library.caltech.edu/records/3x3jc-hbv82">Fermionic Reduced Density Low-Rank Matrix Completion, Noise Filtering, and Measurement Reduction in Quantum Simulations</a>; Journal of Chemical Theory and Computation; PMCID PMC10753808; <a href="https://doi.org/10.1021/acs.jctc.3c00851">10.1021/acs.jctc.3c00851</a></li>
<li>Zhai, Huanchen and Larsson, Henrik R., el al. (2023) <a href="https://authors.library.caltech.edu/records/ve6kx-s2w29">Block2: A comprehensive open source framework to develop and apply state-of-the-art DMRG algorithms in electronic structure and beyond</a>; Journal of Chemical Physics; Vol. 159; No. 23; 234801; <a href="https://doi.org/10.1063/5.0180424">10.1063/5.0180424</a></li>
<li>Zhai, Huanchen and Lee, Seunghoon, el al. (2023) <a href="https://authors.library.caltech.edu/records/p74yx-zq547">Multireference Protonation Energetics of a Dimeric Model of Nitrogenase Iron–Sulfur Clusters</a>; Journal of Physical Chemistry A; Vol. 127; No. 47; 9974-9984; PMCID PMC10694817; <a href="https://doi.org/10.1021/acs.jpca.3c06142">10.1021/acs.jpca.3c06142</a></li>
<li>Lee, Seunghoon and Zhai, Huanchen, el al. (2023) <a href="https://authors.library.caltech.edu/records/dxe1s-0x459">An Ab Initio Correction Vector Restricted Active Space Approach to the L-Edge XAS and 2p3d RIXS Spectra of Transition Metal Complexes</a>; Journal of Chemical Theory and Computation; Vol. 19; No. 21; 7753-7763; PMCID PMC10653107; <a href="https://doi.org/10.1021/acs.jctc.3c00663">10.1021/acs.jctc.3c00663</a></li>
<li>Di Felice, Rosa and Mayes, Maricris L., el al. (2023) <a href="https://authors.library.caltech.edu/records/e6aeh-yg504">A Perspective on Sustainable Computational Chemistry Software Development and Integration</a>; Journal of Chemical Theory and Computation; Vol. 19; No. 20; 7056-7076; PMCID PMC10601486; <a href="https://doi.org/10.1021/acs.jctc.3c00419">10.1021/acs.jctc.3c00419</a></li>
<li>O'Rourke, Matthew J. and Chan, Garnet K. (2023) <a href="https://authors.library.caltech.edu/records/fkj0z-8d375">Entanglement in the quantum phases of an unfrustrated Rydberg atom array</a>; Nature Communications; Vol. 14; 5397; PMCID PMC10480489; <a href="https://doi.org/10.1038/s41467-023-41166-0">10.1038/s41467-023-41166-0</a></li>
<li>Vysotskiy, Victor P. and Torbjörnsson, Magne, el al. (2023) <a href="https://authors.library.caltech.edu/records/yrh59-1sd04">Assessment of DFT functionals for a minimal nitrogenase [Fe(SH)₄H]⁻ model employing state-of-the-art ab initio methods</a>; Journal of Chemical Physics; Vol. 159; No. 4; 044106; <a href="https://doi.org/10.1063/5.0152611">10.1063/5.0152611</a></li>
<li>Mishmash, Ryan V. and Gujarati, Tanvi P., el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230725-856840000.4">Hierarchical Clifford Transformations to Reduce Entanglement in Quantum Chemistry Wave Functions</a>; Journal of Chemical Theory and Computation; Vol. 19; No. 11; 3194-3208; <a href="https://doi.org/10.1021/acs.jctc.3c00228">10.1021/acs.jctc.3c00228</a></li>
<li>Verstraete, Frank and Nishino, Tomotoshi, el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230522-906266000.16">Density matrix renormalization group, 30 years on</a>; Nature Reviews Physics; Vol. 5; No. 5; 273-276; <a href="https://doi.org/10.1038/s42254-023-00572-5">10.1038/s42254-023-00572-5</a></li>
<li>Lee, Seunghoon and Lee, Joonho, el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230630-524987000.10">Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry</a>; Nature Communications; Vol. 14; 1952; PMCID PMC10082187; <a href="https://doi.org/10.1038/s41467-023-37587-6">10.1038/s41467-023-37587-6</a></li>
<li>Li, Chenghan and Yang, Junjie, el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230502-710879200.3">Multi-site reaction dynamics through multi-fragment density matrix embedding</a>; Journal of Chemical Physics; Vol. 158; No. 13; Art. No. 134105; <a href="https://doi.org/10.1063/5.0142961">10.1063/5.0142961</a></li>
<li>White, Alec F. and Li, Chenghan, el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230524-373897000.4">Quantum harmonic free energies for biomolecules and nanomaterials</a>; Nature Computational Science; Vol. 3; No. 4; 328-333; <a href="https://doi.org/10.1038/s43588-023-00432-3">10.1038/s43588-023-00432-3</a></li>
<li>Tölle, Johannes and Chan, Garnet Kin-Lic (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230504-446162300.2">Exact relationships between the GW approximation and equation-of-motion coupled-cluster theories through the quasi-boson formalism</a>; Journal of Chemical Physics; Vol. 158; No. 12; Art. No. 124123; <a href="https://doi.org/10.1063/5.0139716">10.1063/5.0139716</a></li>
<li>Ng, Nathan and Park, Gunhee, el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230328-705664700.12">Real-time evolution of Anderson impurity models via tensor network influence functionals</a>; Physical Review B; Vol. 107; No. 12; Art. No. 125103; <a href="https://doi.org/10.1103/physrevb.107.125103">10.1103/physrevb.107.125103</a></li>
<li>Tan, Adrian T. K. and Sun, Shi-Ning, el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230420-574389200.10">Realizing symmetry-protected topological phases in a spin-1/2 chain with next-nearest-neighbor hopping on superconducting qubits</a>; Physical Review A; Vol. 107; No. 3; Art. No. 032614; <a href="https://doi.org/10.1103/physreva.107.032614">10.1103/physreva.107.032614</a></li>
<li>Peng, Ruojing and Gray, Johnnie, el al. (2023) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230509-419283000.1">Arithmetic circuit tensor networks, multivariable function representation, and high-dimensional integration</a>; Physical Review Research; Vol. 5; No. 1; Art. No. 013156; <a href="https://doi.org/10.1103/physrevresearch.5.013156">10.1103/physrevresearch.5.013156</a></li>
<li>Zhang, Xing and Chan, Garnet Kin-Lic (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20230213-465520400.2">Differentiable quantum chemistry with PʏSCF for molecules and materials at the mean-field level and beyond</a>; Journal of Chemical Physics; Vol. 157; No. 20; Art. No. 204801; <a href="https://doi.org/10.1063/5.0118200">10.1063/5.0118200</a></li>
<li>Tazhigulov, Ruslan N. and Sun, Shi-Ning, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20221202-898320400.1">Simulating Models of Challenging Correlated Molecules and Materials on the Sycamore Quantum Processor</a>; PRX Quantum; Vol. 3; No. 4; Art. No. 040318; <a href="https://doi.org/10.1103/prxquantum.3.040318">10.1103/prxquantum.3.040318</a></li>
<li>Zhai, Huanchen and Chan, Garnet Kin-Lic (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20221109-552977300.2">A comparison between the one- and two-step spin-orbit coupling approaches based on the ab initio density matrix renormalization group</a>; Journal of Chemical Physics; Vol. 157; No. 16; Art. No. 164108; <a href="https://doi.org/10.1063/5.0107805">10.1063/5.0107805</a></li>
<li>Cui, Zhi-Hao and Zhai, Huanchen, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20221205-666301600.3">Systematic electronic structure in the cuprate parent state from quantum many-body simulations</a>; Science; Vol. 377; No. 6611; 1192-1198; <a href="https://doi.org/10.1126/science.abm2295">10.1126/science.abm2295</a></li>
<li>Larsson, Henrik R. and Zhai, Huanchen, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20220908-232209149">The Chromium Dimer: Closing a Chapter of Quantum Chemistry</a>; Journal of the American Chemical Society; Vol. 144; No. 35; 15932-15937; PMCID PMC9460780; <a href="https://doi.org/10.1021/jacs.2c06357">10.1021/jacs.2c06357</a></li>
<li>Niu, Daoheng and Haghshenas, Reza, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20220802-931437000">Holographic Simulation of Correlated Electrons on a Trapped-Ion Quantum Processor</a>; PRX Quantum; Vol. 3; No. 3; Art. No. 030317; <a href="https://doi.org/10.1103/prxquantum.3.030317">10.1103/prxquantum.3.030317</a></li>
<li>Chen, Dian-Teng and Helms, Phillip, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20220307-189668000">Using Hyperoptimized Tensor Networks and First-Principles Electronic Structure to Simulate the Experimental Properties of the Giant {Mn₈₄} Torus</a>; Journal of Physical Chemistry Letters; Vol. 13; No. 10; 2365-2370; <a href="https://doi.org/10.1021/acs.jpclett.2c00354">10.1021/acs.jpclett.2c00354</a></li>
<li>Larsson, Henrik R. and Zhai, Huanchen, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20220125-893621641">Matrix Product States with Large Sites</a>; Journal of Chemical Theory and Computation; Vol. 18; No. 2; 749-762; <a href="https://doi.org/10.1021/acs.jctc.1c00957">10.1021/acs.jctc.1c00957</a></li>
<li>Faulstich, Fabian M. and Kim, Raehyun, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20220202-544261000">Pure State v-Representability of Density Matrix Embedding Theory</a>; Journal of Chemical Theory and Computation; Vol. 18; No. 2; 851-864; <a href="https://doi.org/10.1021/acs.jctc.1c01061">10.1021/acs.jctc.1c01061</a></li>
<li>Haghshenas, Reza and Gray, Johnnie, el al. (2022) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20220315-626090000">Variational Power of Quantum Circuit Tensor Networks</a>; Physical Review X; Vol. 12; No. 1; Art. No. 011047; <a href="https://doi.org/10.1103/physrevx.12.011047">10.1103/physrevx.12.011047</a></li>
<li>Rubin, Nicholas C. and Gunst, Klaas, el al. (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20210527-092223012">The Fermionic Quantum Emulator</a>; Quantum; Vol. 5; Art. No. 568; <a href="https://doi.org/10.22331/q-2021-10-27-568">10.22331/q-2021-10-27-568</a></li>
<li>Ye, Erika and Chan, Garnet Kin-Lic (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20210316-101643523">Constructing tensor network influence functionals for general quantum dynamics</a>; Journal of Chemical Physics; Vol. 155; No. 4; Art. No. 044104; <a href="https://doi.org/10.1063/5.0047260">10.1063/5.0047260</a></li>
<li>Peng, Ruojing and White, Alec F., el al. (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20210713-221644685">Conservation laws in coupled cluster dynamics at finite temperature</a>; Journal of Chemical Physics; Vol. 155; No. 4; Art. No. 044103; <a href="https://doi.org/10.1063/5.0059257">10.1063/5.0059257</a></li>
<li>Zhai, Huanchen and Chan, Garnet Kin-Lic (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20210323-134707908">Low communication high performance ab initio density matrix renormalization group algorithms</a>; Journal of Chemical Physics; Vol. 154; No. 22; Art. No. 224116; <a href="https://doi.org/10.1063/5.0050902">10.1063/5.0050902</a></li>
<li>Lee, Seunghoon and Zhai, Huanchen, el al. (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20210409-075340645">Externally Corrected CCSD with Renormalized Perturbative Triples (R-ecCCSD(T)) and the Density Matrix Renormalization Group and Selected Configuration Interaction External Sources</a>; Journal of Chemical Theory and Computation; Vol. 17; No. 6; 3414-3425; <a href="https://doi.org/10.1021/acs.jctc.1c00205">10.1021/acs.jctc.1c00205</a></li>
<li>Motta, Mario and Ye, Erika, el al. (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20181029-100728436">Low rank representations for quantum simulation of electronic structure</a>; npj Quantum Information; Vol. 7; Art. No. 83; <a href="https://doi.org/10.1038/s41534-021-00416-z">10.1038/s41534-021-00416-z</a></li>
<li>Zhu, Tianyu and Chan, Garnet Kin-Lic (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200420-105853289">Ab Initio Full Cell GW+DMFT for Correlated Materials</a>; Physical Review X; Vol. 11; No. 2; Art. No. 021006; <a href="https://doi.org/10.1103/PhysRevX.11.021006">10.1103/PhysRevX.11.021006</a></li>
<li>Haghshenas, Reza and Cui, Zhi-Hao, el al. (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200923-104453194">Numerical continuum tensor networks in two dimensions</a>; Physical Review Research; Vol. 3; No. 2; Art. No. 023057; <a href="https://doi.org/10.1103/PhysRevResearch.3.023057">10.1103/PhysRevResearch.3.023057</a></li>
<li>Petrica, Gabriel and Zheng, Bo-Xiao, el al. (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20201027-094309674">Finite and infinite matrix product states for Gutzwiller projected mean-field wave functions</a>; Physical Review B; Vol. 103; No. 12; Art. No. 125161; <a href="https://doi.org/10.1103/PhysRevB.103.125161">10.1103/PhysRevB.103.125161</a></li>
<li>Zhu, Tianyu and Chan, Garnet Kin-Lic (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200811-091206924">All-Electron Gaussian-Based G₀W₀ for Valence and Core Excitation Energies of Periodic Systems</a>; Journal of Chemical Theory and Computation; Vol. 17; No. 2; 727-741; <a href="https://doi.org/10.1021/acs.jctc.0c00704">10.1021/acs.jctc.0c00704</a></li>
<li>Sun, Shi-Ning and Motta, Mario, el al. (2021) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20201028-084640144">Quantum Computation of Finite-Temperature Static and Dynamical Properties of Spin Systems Using Quantum Imaginary Time Evolution</a>; PRX Quantum; Vol. 2; No. 1; Art. No. 010317; <a href="https://doi.org/10.1103/PRXQuantum.2.010317">10.1103/PRXQuantum.2.010317</a></li>
<li>White, Alec F. and Gao, Yang, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20201026-152806389">A coupled cluster framework for electrons and phonons</a>; Journal of Chemical Physics; Vol. 153; No. 22; Art. No. 224112; <a href="https://doi.org/10.1063/5.0033132">10.1063/5.0033132</a></li>
<li>Bauer, Bela and Bravyi, Sergey, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20201022-112712261">Quantum Algorithms for Quantum Chemistry and Quantum Materials Science</a>; Chemical Reviews; Vol. 120; No. 22; 12685-12717; <a href="https://doi.org/10.1021/acs.chemrev.9b00829">10.1021/acs.chemrev.9b00829</a></li>
<li>Cui, Zhi-Hao and Sun, Chong, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200303-081531366">Ground-state phase diagram of the three-band Hubbard model from density matrix embedding theory</a>; Physical Review Research; Vol. 2; No. 4; Art. No. 043259; <a href="https://doi.org/10.1103/PhysRevResearch.2.043259">10.1103/PhysRevResearch.2.043259</a></li>
<li>Eriksen, Janus J. and Anderson, Tyler A., el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20201008-071750086">Ground State Electronic Energy of Benzene</a>; Journal of Physical Chemistry Letters; Vol. 11; No. 20; 8922-8929; <a href="https://doi.org/10.1021/acs.jpclett.0c02621">10.1021/acs.jpclett.0c02621</a></li>
<li>Helms, Phillip and Chan, Garnet Kin-Lic (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200504-123744760">Dynamical Phase Transitions in a 2D Classical Nonequilibrium Model via 2D Tensor Networks</a>; Physical Review Letters; Vol. 125; No. 14; Art. No. 140601; <a href="https://doi.org/10.1103/PhysRevLett.125.140601">10.1103/PhysRevLett.125.140601</a></li>
<li>Sun, Qiming and Zhang, Xing, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200710-091035803">Recent developments in the PySCF program package</a>; Journal of Chemical Physics; Vol. 153; No. 2; Art. No. 024109; <a href="https://doi.org/10.1063/5.0006074">10.1063/5.0006074</a></li>
<li>Motta, Mario and Genovese, Claudio, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200914-111807267">Ground-State Properties of the Hydrogen Chain: Dimerization, Insulator-to-Metal Transition, and Magnetic Phases</a>; Physical Review X; Vol. 10; No. 3; Art. No. 031058; <a href="https://doi.org/10.1103/physrevx.10.031058">10.1103/physrevx.10.031058</a></li>
<li>Schurkus, Henry F. and Chan, Garnet Kin-Lic, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200312-142212386">Theoretical prediction of magnetic exchange coupling constants from broken-symmetry coupled cluster calculations</a>; Journal of Chemical Physics; Vol. 152; No. 23; Art. No. 234115; <a href="https://doi.org/10.1063/1.5144696">10.1063/1.5144696</a></li>
<li>Pulkin, Artem and Chan, Garnet Kin-Lic (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200122-092308523">First principles coupled cluster theory of the electronic spectrum of the transition metal dichalcogenides</a>; Physical Review B; Vol. 101; No. 24; Art. No. 241113; <a href="https://doi.org/10.1103/PhysRevB.101.241113">10.1103/PhysRevB.101.241113</a></li>
<li>White, Alec F. and Chan, Garnet Kin-Lic (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200526-082031255">Finite-temperature coupled cluster: Efficient implementation and application to prototypical systems</a>; Journal of Chemical Physics; Vol. 152; No. 22; Art. No. 224104; <a href="https://doi.org/10.1063/5.0009845">10.1063/5.0009845</a></li>
<li>Schurkus, Henry F. and Chen, Dianteng, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200303-082205837">Exploring the magnetic properties of the largest single molecule magnets</a>; Journal of Physical Chemistry Letters; Vol. 11; No. 10; 3789-3795; <a href="https://doi.org/10.1021/acs.jpclett.0c00020">10.1021/acs.jpclett.0c00020</a></li>
<li>O'Rourke, Matthew J. and Chan, Garnet Kin-Lic (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20191218-113037284">A simplified and improved approach to tensor network operators in two dimensions</a>; Physical Review B; Vol. 101; No. 20; Art. No. 205142; <a href="https://doi.org/10.1103/PhysRevB.101.205142">10.1103/PhysRevB.101.205142</a></li>
<li>Gao, Yang and Sun, Qiming, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20191217-105833097">Electronic structure of bulk manganese oxide and nickel oxide from coupled cluster theory</a>; Physical Review B; Vol. 101; No. 16; Art. No. 165138; <a href="https://doi.org/10.1103/PhysRevB.101.165138">10.1103/PhysRevB.101.165138</a></li>
<li>Ray, Ushnish and Chan, Garnet Kin-Lic (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20200122-091951274">Constructing Auxiliary Dynamics for Nonequilibrium Stationary States by Variance Minimization</a>; Journal of Chemical Physics; Vol. 152; No. 10; Art. No. 104107; <a href="https://doi.org/10.1063/1.5143144">10.1063/1.5143144</a></li>
<li>Sun, Chong and Ray, Ushnish, el al. (2020) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20191217-115339743">Finite temperature density matrix embedding theory</a>; Physical Review B; Vol. 101; No. 7; Art. No. 075131; <a href="https://doi.org/10.1103/PhysRevB.101.075131">10.1103/PhysRevB.101.075131</a></li>
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<li>Sharma, Sandeep and Chan, Garnet Kin-Lic (2014) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170106-123434796">Communication: A flexible multi-reference perturbation theory by minimizing the Hylleraas functional with matrix product states</a>; Journal of Chemical Physics; Vol. 141; No. 11; Art. No. 111101; <a href="https://doi.org/10.1063/1.4895977">10.1063/1.4895977</a></li>
<li>Sun, Qiming and Chan, Garnet Kin-Lic (2014) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170106-131952689">Exact and Optimal Quantum Mechanics/Molecular Mechanics Boundaries</a>; Journal of Chemical Theory and Computation; Vol. 10; No. 9; 3784-3790; <a href="https://doi.org/10.1021/ct500512f">10.1021/ct500512f</a></li>
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<li>Chen, Qiaoni and Booth, George H., el al. (2014) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-123256350">Intermediate and spin-liquid phase of the half-filled honeycomb Hubbard model</a>; Physical Review B; Vol. 89; No. 16; Art. No. 165134; <a href="https://doi.org/10.1103/PhysRevB.89.165134">10.1103/PhysRevB.89.165134</a></li>
<li>Sharma, Sandeep and Yanai, Takeshi, el al. (2014) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-131620432">Spectroscopic accuracy directly from quantum chemistry: Application to ground and excited states of beryllium dimer</a>; Journal of Chemical Physics; Vol. 140; No. 10; Art. No. 104112; <a href="https://doi.org/10.1063/1.4867383">10.1063/1.4867383</a></li>
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<li>Clark, Bryan K. and Kinder, Jesse M., el al. (2013) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170126-114330977">Striped Spin Liquid Crystal Ground State Instability of Kagome Antiferromagnets</a>; Physical Review Letters; Vol. 111; No. 18; Art. No. 187205; <a href="https://doi.org/10.1103/PhysRevLett.111.187205">10.1103/PhysRevLett.111.187205</a></li>
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<li>Kurashige, Yuki and Chan, Garnet Kin-Lic, el al. (2013) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170126-090717197">Entangled quantum electronic wavefunctions of the Mn_4CaO_5 cluster in photosystem II</a>; Nature Chemistry; Vol. 5; No. 8; 660-666; <a href="https://doi.org/10.1038/nchem.1677">10.1038/nchem.1677</a></li>
<li>Nakatani, Naoki and Chan, Garnet Kin-Lic (2013) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170126-084951680">Efficient tree tensor network states (TTNS) for quantum chemistry: Generalizations of the density matrix renormalization group algorithm</a>; Journal of Chemical Physics; Vol. 138; No. 13; Art. No. 134113; <a href="https://doi.org/10.1063/1.4798639">10.1063/1.4798639</a></li>
<li>Knizia, Gerald and Chan, Garnet Kin-Lic (2013) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-131915766">Density Matrix Embedding: A Strong-Coupling Quantum Embedding Theory</a>; Journal of Chemical Theory and Computation; Vol. 9; No. 3; 1428-1432; <a href="https://doi.org/10.1021/ct301044e">10.1021/ct301044e</a></li>
<li>Schütz, Martin and Yang, Jun, el al. (2013) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-130249271">The orbital-specific virtual local triples correction: OSV-L(T)</a>; Journal of Chemical Physics; Vol. 138; No. 5; Art. No. 054109; <a href="https://doi.org/10.1063/1.4789415">10.1063/1.4789415</a></li>
<li>Booth, George H. and Chan, Garnet Kin-Lic (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-103855780">Communication: Excited states, dynamic correlation functions and spectral properties from full configuration interaction quantum Monte Carlo</a>; Journal of Chemical Physics; Vol. 137; No. 19; Art. No. 191102; <a href="https://doi.org/10.1063/1.4766327">10.1063/1.4766327</a></li>
<li>Watson, Mark A. and Chan, Garnet Kin-Lic (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-092628371">Excited States of Butadiene to Chemical Accuracy: Reconciling Theory and Experiment</a>; Journal of Chemical Theory and Computation; Vol. 8; No. 11; 4013-4018; <a href="https://doi.org/10.1021/ct300591z">10.1021/ct300591z</a></li>
<li>Knizia, Gerald and Chan, Garnet Kin-Lic (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-102508309">Density Matrix Embedding: A Simple Alternative to Dynamical Mean-Field Theory</a>; Physical Review Letters; Vol. 109; No. 18; Art. No. 186404; <a href="https://doi.org/10.1103/PhysRevLett.109.186404">10.1103/PhysRevLett.109.186404</a></li>
<li>Chan, Garnet Kin-Lic (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-101721268">Low entanglement wavefunctions</a>; Wiley Interdisciplinary Reviews: Computational Molecular Science; Vol. 2; No. 6; 907-920; <a href="https://doi.org/10.1002/wcms.1095">10.1002/wcms.1095</a></li>
<li>Zgid, Dominika and Gull, Emanuel, el al. (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-095443515">Truncated configuration interaction expansions as solvers for correlated quantum impurity models and dynamical mean-field theory</a>; Physical Review B; Vol. 86; No. 16; Art. No. 165128; <a href="https://doi.org/10.1103/PhysRevB.86.165128">10.1103/PhysRevB.86.165128</a></li>
<li>Neuscamman, Eric and Chan, Garnet Kin-Lic (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-085528019">Correlator product state study of molecular magnetism in the giant Keplerate Mo₇₂Fe₃₀</a>; Physical Review B; Vol. 86; No. 6; Art. No. 064402; <a href="https://doi.org/10.1103/PhysRevB.86.064402">10.1103/PhysRevB.86.064402</a></li>
<li>Yanai, Takeshi and Kurashige, Yuki, el al. (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-154017798">Extended implementation of canonical transformation theory: parallelization and a new level-shifted condition</a>; Physical Chemistry Chemical Physics; Vol. 14; No. 21; 7809-7820; <a href="https://doi.org/10.1039/C2CP23767A">10.1039/C2CP23767A</a></li>
<li>Yang, Jun and Chan, Garnet Kin-Lic, el al. (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-082210424">The orbital-specific-virtual local coupled cluster singles and doubles method</a>; Journal of Chemical Physics; Vol. 136; No. 14; Art. No. 144105; <a href="https://doi.org/10.1063/1.3696963">10.1063/1.3696963</a></li>
<li>Sharma, Sandeep and Chan, Garnet Kin-Lic (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170125-080044523">Spin-adapted density matrix renormalization group algorithms for quantum chemistry</a>; Journal of Chemical Physics; Vol. 136; No. 12; Art. No. 124121; <a href="https://doi.org/10.1063/1.3695642">10.1063/1.3695642</a></li>
<li>Kurashige, Yuki and Yang, Jun, el al. (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-163017678">Optimization of orbital-specific virtuals in local Møller-Plesset perturbation theory</a>; Journal of Chemical Physics; Vol. 136; No. 12; Art. No. 124106; <a href="https://doi.org/10.1063/1.3696962">10.1063/1.3696962</a></li>
<li>Neuscamman, Eric and Umrigar, C. J., el al. (2012) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-161948930">Optimizing large parameter sets in variational quantum Monte Carlo</a>; Physical Review B; Vol. 85; No. 4; Art. No. 045103; <a href="https://doi.org/10.1103/PhysRevB.85.045103">10.1103/PhysRevB.85.045103</a></li>
<li>Hachmann, Johannes and Frazier, Brenda A., el al. (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-150632032">A Theoretical Study of the 3d-M(smif)_2 Complexes: Structure, Magnetism, and Oxidation States</a>; ChemPhysChem; Vol. 12; No. 17; 3236-3244; <a href="https://doi.org/10.1002/cphc.201100286">10.1002/cphc.201100286</a></li>
<li>Neuscamman, Eric and Changlani, Hitesh, el al. (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-144101163">Nonstochastic algorithms for Jastrow-Slater and correlator product state wave functions</a>; Physical Review B; Vol. 84; No. 20; Art No. 205132; <a href="https://doi.org/10.1103/PhysRevB.84.205132">10.1103/PhysRevB.84.205132</a></li>
<li>Kinder, Jesse M. and Chan, Garnet Kin-Lic, el al. (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-141757838">Uniform peak optical conductivity in single-walled carbon nanotubes</a>; Physical Review B; Vol. 84; No. 12; Art. No. 125428; <a href="https://doi.org/10.1103/PhysRevB.84.125428">10.1103/PhysRevB.84.125428</a></li>
<li>Tam, Eugenia S. and Parks, Joshua J., el al. (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-132316995">Single-Molecule Conductance of Pyridine-Terminated Dithienylethene Switch Molecules</a>; ACS Nano; Vol. 5; No. 6; 5115-5123; <a href="https://doi.org/10.1021/nn201199b">10.1021/nn201199b</a></li>
<li>Chan, Garnet Kin-Lic and Sharma, Sandeep (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-163528165">The Density Matrix Renormalization Group in Quantum Chemistry</a>; Annual Review of Physical Chemistry; Vol. 62; 465-481; <a href="https://doi.org/10.1146/annurev-physchem-032210-103338">10.1146/annurev-physchem-032210-103338</a></li>
<li>Zgid, Dominika and Chan, Garnet Kin-Lic (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-121021332">Dynamical mean-field theory from a quantum chemical perspective</a>; Journal of Chemical Physics; Vol. 134; No. 9; Art. No. 094115; <a href="https://doi.org/10.1063/1.3556707">10.1063/1.3556707</a></li>
<li>Yang, Jun and Kurashige, Yuki, el al. (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-115017117">Tensor factorizations of local second-order Møller–Plesset theory</a>; Journal of Chemical Physics; Vol. 134; No. 4; Art. No. 044123; <a href="https://doi.org/10.1063/1.3528935">10.1063/1.3528935</a></li>
<li>Joh, Daniel Y. and Herman, Lihong H., el al. (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-100413294">On-Chip Rayleigh Imaging and Spectroscopy of Carbon Nanotubes</a>; Nano Letters; Vol. 11; No. 1; 1-7; <a href="https://doi.org/10.1021/nl1012568">10.1021/nl1012568</a></li>
<li>Joh, Daniel Y. and Kinder, Jesse, el al. (2011) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-112309037">Single-walled carbon nanotubes as excitonic optical wires</a>; Nature Nanotechnology; Vol. 6; No. 1; 51-56; <a href="https://doi.org/10.1038/nnano.2010.248">10.1038/nnano.2010.248</a></li>
<li>Parks, J. J. and Champagne, A. R., el al. (2010) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170120-092308917">Mechanical Control of Spin States in Spin-1 Molecules and the Underscreened Kondo Effect</a>; Science; Vol. 328; No. 5984; 1370-1373; <a href="https://doi.org/10.1126/science.1186874">10.1126/science.1186874</a></li>
<li>Yanai, Takeshi and Kurashige, Yuki, el al. (2010) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-165047744">Multireference quantum chemistry through a joint density matrix renormalization group and canonical transformation theory</a>; Journal of Chemical Physics; Vol. 132; No. 2; Art. No. 024105; <a href="https://doi.org/10.1063/1.3275806">10.1063/1.3275806</a></li>
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<li>Neuscamman, Eric and Yanai, Takeshi, el al. (2010) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-174042015">A review of canonical transformation theory</a>; International Reviews in Physical Chemistry; Vol. 29; No. 2; 231-271; <a href="https://doi.org/10.1080/01442351003620540">10.1080/01442351003620540</a></li>
<li>Changlani, Hitesh J. and Kinder, Jesse M., el al. (2009) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-161455636">Approximating strongly correlated wave functions with correlator product states</a>; Physical Review B; Vol. 80; No. 24; Art. No. 245116; <a href="https://doi.org/10.1103/PhysRevB.80.245116">10.1103/PhysRevB.80.245116</a></li>
<li>Yanai, Takeshi and Kurashige, Yuki, el al. (2009) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-140628612">Accelerating convergence in iterative solution for large-scale complete active space self-consistent-field calculations</a>; International Journal of Quantum Chemistry; Vol. 109; No. 10; 2178-2190; <a href="https://doi.org/10.1002/qua.22099">10.1002/qua.22099</a></li>
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<li>Dorando, Jonathan J. and Hachmann, Johannes, el al. (2009) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-154116914">Analytic response theory for the density matrix renormalization group</a>; Journal of Chemical Physics; Vol. 130; No. 18; Art. No. 184111; <a href="https://doi.org/10.1063/1.3121422">10.1063/1.3121422</a></li>
<li>Kinder, Jesse M. and Dorando, Jonathan J., el al. (2009) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-150413994">Perfect Reflection of Chiral Fermions in Gated Graphene Nanoribbons</a>; Nano Letters; Vol. 9; No. 5; 1980-1983; <a href="https://doi.org/10.1021/nl900227e">10.1021/nl900227e</a></li>
<li>Neuscamman, Eric and Yanai, Takeshi, el al. (2009) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170113-144535982">Quadratic canonical transformation theory and higher order density matrices</a>; Journal of Chemical Physics; Vol. 130; No. 12; Art. No. 124102; <a href="https://doi.org/10.1063/1.3086932">10.1063/1.3086932</a></li>
<li>Chan, Garnet Kin-Lic (2008) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170106-180109128">Density matrix renormalisation group Lagrangians</a>; Physical Chemistry Chemical Physics; Vol. 10; No. 23; 3454-3459; <a href="https://doi.org/10.1039/B805292C">10.1039/B805292C</a></li>
<li>Ghosh, Debashree and Hachmann, Johannes, el al. (2008) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170106-170844658">Orbital optimization in the density matrix renormalization group, with applications to polyenes and β-carotene</a>; Journal of Chemical Physics; Vol. 128; No. 14; Art. No. 144117; <a href="https://doi.org/10.1063/1.2883976">10.1063/1.2883976</a></li>
<li>Wang, Haitao and Chan, Garnet Kin-Lic (2007) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161221-080745676">Self-interaction and molecular Coulomb blockade transport in ab initio Hartree-Fock theory</a>; Physical Review B; Vol. 76; No. 19; Art. No. 193310; <a href="https://doi.org/10.1103/PhysRevB.76.193310">10.1103/PhysRevB.76.193310</a></li>
<li>Hachmann, Johannes and Dorando, Jonathan J., el al. (2007) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161221-080745931">The radical character of the acenes: A density matrix renormalization group study</a>; Journal of Chemical Physics; Vol. 127; No. 13; Art. No. 134309; <a href="https://doi.org/10.1063/1.2768362">10.1063/1.2768362</a></li>
<li>Yanai, Takeshi and Chan, Garnet Kin-Lic (2007) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170106-145921842">Canonical transformation theory from extended normal ordering</a>; Journal of Chemical Physics; Vol. 127; No. 10; Art. No. 104107; <a href="https://doi.org/10.1063/1.2761870">10.1063/1.2761870</a></li>
<li>Dorando, Jonathan J. and Hachmann, Johannes, el al. (2007) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20170106-155502992">Targeted excited state algorithms</a>; Journal of Chemical Physics; Vol. 127; No. 8; Art. No. 084109; <a href="https://doi.org/10.1063/1.2768360">10.1063/1.2768360</a></li>
<li>Hachmann, Johannes and Cardoen, Wim, el al. (2006) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-115105133">Multireference correlation in long molecules with the quadratic scaling density matrix renormalization group</a>; Journal of Chemical Physics; Vol. 125; No. 14; Art. No. 144101; <a href="https://doi.org/10.1063/1.2345196">10.1063/1.2345196</a></li>
<li>Yanai, Takeshi and Chan, Garnet Kin-Lic (2006) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161221-080745056">Canonical transformation theory for multireference problems</a>; Journal of Chemical Physics; Vol. 124; No. 19; Art. No. 194106; <a href="https://doi.org/10.1063/1.2196410">10.1063/1.2196410</a></li>
<li>Hino, Osamu and Kinoshita, Tomoko, el al. (2006) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161221-080745403">Tailored coupled cluster singles and doubles method applied to calculations on molecular structure and harmonic vibrational frequencies of ozone</a>; Journal of Chemical Physics; Vol. 124; No. 11; Art. No. 114311; <a href="https://doi.org/10.1063/1.2180775">10.1063/1.2180775</a></li>
<li>Chan, Garnet Kin-Lic and Finken, Reimar (2005) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-115104640">Time-Dependent Density Functional Theory of Classical Fluids</a>; Physical Review Letters; Vol. 94; No. 18; Art. No. 183001; <a href="https://doi.org/10.1103/PhysRevLett.94.183001">10.1103/PhysRevLett.94.183001</a></li>
<li>Chan, Garnet Kin-Lic and Van Voorhis, Troy (2005) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-115104349">Density-matrix renormalization-group algorithms with nonorthogonal orbitals and non-Hermitian operators, and applications to polyenes</a>; Journal of Chemical Physics; Vol. 122; No. 20; 204101; <a href="https://doi.org/10.1063/1.1899124">10.1063/1.1899124</a></li>
<li>Galek, Peter T. A. and Handy, Nicholas C., el al. (2005) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-115104900">Hartree–Fock orbitals which obey the nuclear cusp condition</a>; Chemical Physics Letters; Vol. 404; No. 1-3; 156-163; <a href="https://doi.org/10.1016/j.cplett.2005.01.071">10.1016/j.cplett.2005.01.071</a></li>
<li>Chan, Garnet Kin-Lic and Kállay, Mihály, el al. (2004) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-101809677">State-of-the-art density matrix renormalization group and coupled cluster theory studies of the nitrogen binding curve</a>; Journal of Chemical Physics; Vol. 121; No. 13; 6110-6116; <a href="https://doi.org/10.1063/1.1783212">10.1063/1.1783212</a></li>
<li>Hachmann, Johannes and Galek, Peter T. A., el al. (2004) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-101809954">The nodes of Hartree–Fock wavefunctions and their orbitals</a>; Chemical Physics Letters; Vol. 392; No. 1-3; 55-61; <a href="https://doi.org/10.1016/j.cplett.2004.04.070">10.1016/j.cplett.2004.04.070</a></li>
<li>Chan, Garnet Kin-Lic (2004) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-101810190">An algorithm for large scale density matrix renormalization group calculations</a>; Journal of Chemical Physics; Vol. 120; No. 7; 3172-3178; <a href="https://doi.org/10.1063/1.1638734">10.1063/1.1638734</a></li>
<li>Chan, Garnet Kin-Lic and Head-Gordon, Martin (2003) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-101809383">Exact solution (within a triple-zeta, double polarization basis set) of the electronic Schrödinger equation for water</a>; Journal of Chemical Physics; Vol. 118; No. 19; 8551-8554; <a href="https://doi.org/10.1063/1.1574318">10.1063/1.1574318</a></li>
<li>Chan, Garnet Kin-Lic and Ayers, Paul W., el al. (2002) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-095020187">On the Distribution of Eigenvalues of Grand Canonical Density Matrices</a>; Journal of Statistical Physics; Vol. 109; No. 1/2; 289-299; <a href="https://doi.org/10.1023/A:1019999930923">10.1023/A:1019999930923</a></li>
<li>Chan, Garnet Kin-Lic and Head-Gordon, Martin (2002) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-095020446">Highly correlated calculations with a polynomial cost algorithm: A study of the density matrix renormalization group</a>; Journal of Chemical Physics; Vol. 116; No. 11; 4462-4476; <a href="https://doi.org/10.1063/1.1449459">10.1063/1.1449459</a></li>
<li>Chan, Garnet Kin-Lic and Cohen, Aron J., el al. (2001) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20161220-095019830">Thomas–Fermi–Dirac–von Weizsäcker models in finite systems</a>; Journal of Chemical Physics; Vol. 114; No. 2; 631-638; <a href="https://doi.org/10.1063/1.1321308">10.1063/1.1321308</a></li>
<li>Chan, Garnet Kin-Lic and Handy, Nicholas C. (2000) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20160729-151752866">An extensive study of gradient approximations to the exchange-correlation and kinetic energy functionals</a>; Journal of Chemical Physics; Vol. 112; No. 13; 5639-5653; <a href="https://doi.org/10.1063/1.481139">10.1063/1.481139</a></li>
<li>Chan, Garnet Kin-Lic and Handy, Nicholas C. (1999) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20160715-141302677">Optimized Lieb-Oxford bound for the exchange-correlation energy</a>; Physical Review A; Vol. 59; No. 4; 3075-3077; <a href="https://doi.org/10.1103/PhysRevA.59.3075">10.1103/PhysRevA.59.3075</a></li>
<li>Chan, Garnet Kin-Lic and Handy, Nicholas C. (1999) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20160715-144501877">Kinetic-energy systems, density scaling, and homogeneity relations in density-functional theory</a>; Physical Review A; Vol. 59; No. 4; 2670-2679; <a href="https://doi.org/10.1103/PhysRevA.59.2670">10.1103/PhysRevA.59.2670</a></li>
<li>Chan, Garnet Kin-Lic (1999) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20160715-151036445">A fresh look at ensembles: Derivative discontinuities in density functional theory</a>; Journal of Chemical Physics; Vol. 110; No. 10; 4710-4723; <a href="https://doi.org/10.1063/1.478357">10.1063/1.478357</a></li>
<li>Chan, Garnet Kin-Lic and Handy, Nicholas C. (1998) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20160708-143819437">A new chemical concept: Shape chemical potentials</a>; Journal of Chemical Physics; Vol. 109; No. 15; 6287-6295; <a href="https://doi.org/10.1063/1.477270">10.1063/1.477270</a></li>
<li>Chan, Garnet K-L. and Tozer, David J., el al. (1997) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20160708-132354083">Correlation potentials and functionals in Hartree-Fock-Kohn-Sham theory</a>; Journal of Chemical Physics; Vol. 107; No. 5; 1536-1543; <a href="https://doi.org/10.1063/1.474506">10.1063/1.474506</a></li>
<li>Chan, Garnet K-L. and Handy, Nicholas C. (1996) <a href="https://resolver.caltech.edu/CaltechAUTHORS:20160708-125611760">C_8H_8: a density functional theory study of molecular geometries introducing the localised bond density</a>; Journal of the Chemical Society, Faraday Transactions; Vol. 92; No. 17; 3015-3021; <a href="https://doi.org/10.1039/FT9969203015">10.1039/FT9969203015</a></li>
</ul>