Garnet Kin-Lic Chan
Garnet Kin-Lic Chan
Division of Chemistry and Chemical Engineering, California Institute of Technology
Verifierad e-postadress på caltech.edu
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Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
Y Shao, Z Gan, E Epifanovsky, ATB Gilbert, M Wormit, J Kussmann, ...
Molecular Physics 113 (2), 184-215, 2015
23252015
PySCF: the Python‐based simulations of chemistry framework
Q Sun, TC Berkelbach, NS Blunt, GH Booth, S Guo, Z Li, J Liu, ...
Wiley Interdisciplinary Reviews: Computational Molecular Science 8 (1), e1340, 2018
5942018
The density matrix renormalization group in quantum chemistry
GKL Chan, S Sharma
Annual review of physical chemistry 62, 465-481, 2011
5742011
Highly correlated calculations with a polynomial cost algorithm: A study of the density matrix renormalization group
GKL Chan, M Head-Gordon
The Journal of chemical physics 116 (11), 4462-4476, 2002
5092002
The radical character of the acenes: a density matrix renormalization group study
J Hachmann, JJ Dorando, M Avilés, GKL Chan
The Journal of chemical physics 127 (13), 134309, 2007
4462007
Solutions of the two-dimensional Hubbard model: Benchmarks and results from a wide range of numerical algorithms
JPF LeBlanc, AE Antipov, F Becca, IW Bulik, GKL Chan, CM Chung, ...
Physical Review X 5 (4), 041041, 2015
3992015
Mechanical control of spin states in spin-1 molecules and the underscreened Kondo effect
JJ Parks, AR Champagne, TA Costi, WW Shum, AN Pasupathy, ...
Science 328 (5984), 1370-1373, 2010
3892010
Low-depth quantum simulation of materials
R Babbush, N Wiebe, J McClean, J McClain, H Neven, GKL Chan
Physical Review X 8 (1), 011044, 2018
374*2018
Density matrix embedding: A simple alternative to dynamical mean-field theory
G Knizia, GKL Chan
Physical review letters 109 (18), 186404, 2012
3692012
Stripe order in the underdoped region of the two-dimensional Hubbard model
BX Zheng, CM Chung, P Corboz, G Ehlers, MP Qin, RM Noack, H Shi, ...
Science 358 (6367), 1155-1160, 2017
3162017
Orbital optimization in the density matrix renormalization group, with applications to polyenes and -carotene
D Ghosh, J Hachmann, T Yanai, GKL Chan
The Journal of chemical physics 128 (14), 144117, 2008
3162008
The ab-initio density matrix renormalization group in practice
R Olivares-Amaya, W Hu, N Nakatani, S Sharma, J Yang, GKL Chan
The Journal of chemical physics 142 (3), 034102, 2015
2602015
Entangled quantum electronic wavefunctions of the Mn 4 CaO 5 cluster in photosystem II
Y Kurashige, GKL Chan, T Yanai
Nature chemistry 5 (8), 660-666, 2013
2382013
Density matrix embedding: A strong-coupling quantum embedding theory
G Knizia, GKL Chan
Journal of chemical theory and computation 9 (3), 1428-1432, 2013
2372013
Spin-adapted density matrix renormalization group algorithms for quantum chemistry
S Sharma, GKL Chan
The Journal of chemical physics 136 (12), 124121, 2012
2372012
Quantum simulation of electronic structure with linear depth and connectivity
ID Kivlichan, J McClean, N Wiebe, C Gidney, A Aspuru-Guzik, GKL Chan, ...
Physical review letters 120 (11), 110501, 2018
2292018
Ab initio determination of the crystalline benzene lattice energy to sub-kilojoule/mole accuracy
J Yang, W Hu, D Usvyat, D Matthews, M Schütz, GKL Chan
Science 345 (6197), 640-643, 2014
2262014
Low-energy spectrum of iron–sulfur clusters directly from many-particle quantum mechanics
S Sharma, K Sivalingam, F Neese, GKL Chan
Nature chemistry 6 (10), 927-933, 2014
2252014
Determining eigenstates and thermal states on a quantum computer using quantum imaginary time evolution
M Motta, C Sun, ATK Tan, MJ O’Rourke, E Ye, AJ Minnich, FGSL Brandão, ...
Nature Physics 16 (2), 205-210, 2020
2202020
Canonical transformation theory for multireference problems
T Yanai, GKL Chan
The Journal of chemical physics 124 (19), 194106, 2006
2142006
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Artiklar 1–20