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Organic & Biomolecular Chemistry|July 13, 2005
Ab initio MO study on [3 + 2] annulation using beta-phenylthio-acryloylsilanes with alkyl methyl ketone enolates and its through-space/bond interaction analysisYuuichi Orimoto, Kazunari Naka, Kei Takeda, et al.The Journal of Physical Chemistry. A|April 28, 2006
Ab initio MO analysis of interaction paths between radicals in ferromagnetic organic systemsYuuichi Orimoto, Takahiro Imai, Kazunari Naka, et al.The Journal of Physical Chemistry. A|July 13, 2006
Bimetallic clusters Pt6Au: geometric and electronic structures within density functional theoryWei Quan Tian, Maofa Ge, Fenglong Gu, et al.Journal of Computational Chemistry|December 19, 2009
Describing electron correlation effects in the framework of the elongation method--elongation-MP2: formalism, implementation and efficiencyMarcin Makowski, Jacek Korchowiec, Feng Long Gu, et al.Journal of Computational Chemistry|July 27, 2006
Efficiency and accuracy of the elongation method as applied to the electronic structures of large systemsMarcin Makowski, Jacek Korchowiec, Feng Long Gu, et al.The Journal of Chemical Physics|June 15, 2007
Efficient and accurate calculations on the electronic structure of B-type poly(dG).poly(dC) DNA by elongation method: first step toward the understanding of the biological properties of aperiodic DNAYuuichi Orimoto, Feng Long Gu, Akira Imamura, et al.Journal of Computational Chemistry|July 16, 2009
Theoretical study on nonlinear optical properties of the Li(+)[calix[4]pyrrole]Li(-)dimer, trimer and its polymer with diffuse excess electronsGuang Tao Yu, Wei Chen, Feng Long Gu, et al.The Journal of Chemical Physics|September 4, 2007
Nonlinear optical properties of polydiacetylene with donor-acceptor substitution blockShin-Ichi Ohnishi, Yuuichi Orimoto, Feng Long Gu, et al.The Journal of Chemical Physics|August 3, 2021
Ab initio multi-level layered elongation method and its application to local interaction analysis between DNA bulge and ligand moleculesKeisuke Hisama, Yuuichi Orimoto, Anna Pomogaeva, et al.Physical Chemistry Chemical Physics : PCCP|June 6, 2022
Why does 2-(2-aminoethylamino)ethanol have superior CO2 separation performance to monoethanolamine? A computational studyDaiki Aso, Yuuichi Orimoto, Makoto Higashino, et al.Pageof 550