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Nakano, Masahiko, Yoshikawa, Takeshi, Hirata, So, Seino, Junji, Nakai, Hiromi (2017) Computerized implementation of higher-order electron-correlation methods and their linear-scaling divide-and-conquer extensions. Journal of Computational Chemistry, 38 (29). 2520-2527 doi:10.1002/jcc.24912

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Reference TypeJournal (article/letter/editorial)
TitleComputerized implementation of higher-order electron-correlation methods and their linear-scaling divide-and-conquer extensions
JournalJournal of Computational Chemistry
AuthorsNakano, MasahikoAuthor
Yoshikawa, TakeshiAuthor
Hirata, SoAuthor
Seino, JunjiAuthor
Nakai, HiromiAuthor
Year2017 (November 5)Volume38
Issue29
PublisherWiley
DOIdoi:10.1002/jcc.24912Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID3152304Long-form Identifiermindat:1:5:3152304:0
GUID0
Full ReferenceNakano, Masahiko, Yoshikawa, Takeshi, Hirata, So, Seino, Junji, Nakai, Hiromi (2017) Computerized implementation of higher-order electron-correlation methods and their linear-scaling divide-and-conquer extensions. Journal of Computational Chemistry, 38 (29). 2520-2527 doi:10.1002/jcc.24912
Plain TextNakano, Masahiko, Yoshikawa, Takeshi, Hirata, So, Seino, Junji, Nakai, Hiromi (2017) Computerized implementation of higher-order electron-correlation methods and their linear-scaling divide-and-conquer extensions. Journal of Computational Chemistry, 38 (29). 2520-2527 doi:10.1002/jcc.24912
In(2017, November) Journal of Computational Chemistry Vol. 38 (29) Wiley

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Hayami, Masao, Seino, Junji, Nakajima, Yuya, Nakano, Masahiko, Ikabata, Yasuhiro, Yoshikawa, Takeshi, Oyama, Takuro, Hiraga, Kenta, Hirata, So, Nakai, Hiromi (2018) RAQET: Large-scale two-component relativistic quantum chemistry program package. Journal of Computational Chemistry, 39 (27). 2333-2344 doi:10.1002/jcc.25364
Nakai, Hiromi, Kobayashi, Masato, Yoshikawa, Takeshi, Seino, Junji, Ikabata, Yasuhiro, Nishimura, Yoshifumi (2023) Divide-and-Conquer Linear-Scaling Quantum Chemical Computations. The Journal of Physical Chemistry A, 127 (3) 589-618 doi:10.1021/acs.jpca.2c06965
Yoshikawa, Takeshi, Nakai, Hiromi (2015) Linear-scaling self-consistent field calculations based on divide-and-conquer method using resolution-of-identity approximation on graphical processing units. Journal of Computational Chemistry, 36 (3). 164-170 doi:10.1002/jcc.23782
Yoshikawa, Takeshi, Doi, Toshiki, Nakai, Hiromi (2019) Finite-temperature-based linear-scaling divide-and-conquer self-consistent field method for static electron correlation systems. Chemical Physics Letters, 725. 18-23 doi:10.1016/j.cplett.2019.04.001
Akama, Tomoko, Kobayashi, Masato, Nakai, Hiromi (2007) Implementation of divide-and-conquer method including Hartree-Fock exchange interaction. Journal of Computational Chemistry, 28 (12). 2003-2012 doi:10.1002/jcc.20707
Yoshikawa, Takeshi, Komoto, Nana, Nishimura, Yoshifumi, Nakai, Hiromi (2019) GPU‐Accelerated Large‐Scale Excited‐State Simulation Based on Divide‐and‐Conquer Time‐Dependent Density‐Functional Tight‐Binding. Journal of Computational Chemistry, 40 (31). 2778-2786 doi:10.1002/jcc.26053
Nishimura, Yoshifumi, Nakai, Hiromi (2018) Parallel implementation of efficient charge-charge interaction evaluation scheme in periodic divide-and-conquer density-functional tight-binding calculations. Journal of Computational Chemistry, 39 (2). 105-116 doi:10.1002/jcc.25086
Seino, Junji, Nakai, Hiromi (2016) Informatics‐Based Energy Fitting Scheme for Correlation Energy at Complete Basis Set Limit. Journal of Computational Chemistry, 37 (25). 2304-2315 doi:10.1002/jcc.24455
Ikabata, Yasuhiro, Fujisawa, Ryo, Seino, Junji, Yoshikawa, Takeshi, Nakai, Hiromi (2020) Machine-learned electron correlation model based on frozen core approximation. The Journal of Chemical Physics, 153 (18) 184108pp. doi:10.1063/5.0021281
Kobayashi, Masato, Yoshikawa, Takeshi, Nakai, Hiromi (2010) Divide-and-conquer self-consistent field calculation for open-shell systems: Implementation and application. Chemical Physics Letters, 500. 172-177 doi:10.1016/j.cplett.2010.10.005
Nakano, Masahiko, Seino, Junji, Nakai, Hiromi (2017) Universal formulation of second-order generalized Møller–Plesset perturbation theory for a spin-dependent two-component relativistic many-electron Hamiltonian. Chemical Physics Letters, 675. 137-144 doi:10.1016/j.cplett.2017.03.027
 
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