Zobrazeno 1 - 10
of 30
pro vyhledávání: '"Zhi-hao Cui"'
Autor:
Seunghoon Lee, Joonho Lee, Huanchen Zhai, Yu Tong, Alexander M. Dalzell, Ashutosh Kumar, Phillip Helms, Johnnie Gray, Zhi-Hao Cui, Wenyuan Liu, Michael Kastoryano, Ryan Babbush, John Preskill, David R. Reichman, Earl T. Campbell, Edward F. Valeev, Lin Lin, Garnet Kin-Lic Chan
Publikováno v:
Nature Communications, Vol 14, Iss 1, Pp 1-7 (2023)
The extent of problems in quantum chemistry for which quantum algorithms could provide a speedup is still unclear, as well as the kind of speedup one should expect. Here, the authors look at the problem of ground state energy estimation, and gather t
Externí odkaz:
https://doaj.org/article/bf9e0274d52c4891bee800a0d650eeba
Publikováno v:
Geofluids, Vol 2023 (2023)
In this study, a combined anisotropic random field and GPU-accelerated Cholesky decomposition algorithm is proposed for diversion tunnel excavation. With the MATLAB programming control be used to combine the advantages of GPU and CPU computing, the e
Externí odkaz:
https://doaj.org/article/556bb835efe24d9fb2871ef93e774171
Publikováno v:
Physical Review Research, Vol 3, Iss 2, p 023057 (2021)
We describe the use of tensor networks to numerically determine wave functions of interacting two-dimensional fermionic models in the continuum limit. We use two different tensor network states: one based on the numerical continuum limit of fermionic
Externí odkaz:
https://doaj.org/article/e8c21005ead944e7b92589454b6218b5
Publikováno v:
Physical Review Research, Vol 2, Iss 4, p 043259 (2020)
We determine the ground-state phase diagram of the three-band Hubbard model across a range of model parameters using density matrix embedding theory. We study the atomic-scale nature of the antiferromagnetic (AFM) and superconducting (SC) orders, exp
Externí odkaz:
https://doaj.org/article/46396a6307e740ccb4776090df0c1a7c
Publikováno v:
Science. 9/9/2022, Vol. 377 Issue 6611, p1192-1198. 7p. 5 Graphs.
Publikováno v:
Journal of Chemical Theory and Computation. 18:851-864
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1a3e860f84ed803023a237e88056a17e
https://doi.org/10.1021/acs.jctc.1c01061
https://doi.org/10.1021/acs.jctc.1c01061
Autor:
Yang-Fan He, Bin Sun, Ming-Jiang Ma, Wei Li, Qiang-You He, Zhi-Hao Cui, Shao-Yi Wang, Zong-Qing Zhao
Publikováno v:
Nuclear Science and Techniques. 33
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d019aba0c15b593cb818dc4dce47d68d
https://doi.org/10.1007/s41365-022-01101-2
https://doi.org/10.1007/s41365-022-01101-2
Publikováno v:
ACS Catalysis. 10:13867-13877
Borides have been recently identified to be a class of earth-abundant and low-cost materials that are surprisingly active toward oxidative dehydrogenation and hydrogen evolution reaction (HER) cata...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9d5f29bf162d7848696b0243a5cba442
https://doi.org/10.1021/acscatal.0c03410
https://doi.org/10.1021/acscatal.0c03410
Publikováno v:
Journal of chemical theory and computation. 18(2)
Density matrix embedding theory (DMET) formally requires the matching of density matrix blocks obtained from high-level and low-level theories, but this is sometimes not achievable in practical calculations. In such a case, the global band gap of the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::ece7034551106a8b2998775ec0e203b2
https://pubmed.ncbi.nlm.nih.gov/35084855
https://pubmed.ncbi.nlm.nih.gov/35084855
Publikováno v:
Journal of Chemical Theory and Computation. 16:141-153
We present an efficient ab initio dynamical mean-field theory (DMFT) implementation for quantitative simulations in solids. Our DMFT scheme employs ab initio Hamiltonians defined for impurities comprising the full unit cell or a supercell of atoms an
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::47506ece16d226b19d05bf17b7941cd4
https://doi.org/10.1021/acs.jctc.9b00934
https://doi.org/10.1021/acs.jctc.9b00934