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Showing results 1 to 11 of 11
TypeAuthor(s)TitleOther TitlesCitationCitation(alt)Issue Date
articleKitagawa, Yuichi; Wada, Satoshi; Islam, M. D. Jahidul; Saita, Kenichiro; Gon, Masayuki; Fushimi, Koji; Tanaka, Kazuo; Maeda, Satoshi; Hasegawa, YasuchikaChiral lanthanide lumino-glass for a circularly polarized light security device-Communications Chemistry-25-Aug-2020
articleMita, Tsuyoshi; Harabuchi, Yu; Maeda, SatoshiDiscovery of a synthesis method for a difluoroglycine derivative based on a path generated by quantum chemical calculations-Chemical science-7-Aug-2020
articleNabata, Hitoshi; Takagi, Makito; Saita, Kenichiro; Maeda, SatoshiComputational searches for crystal structures of dioxides of group 14 elements (CO2, SiO2, GeO2) under ultrahigh pressure-RSC advances-9-Jun-2020
article (author version)Sugiyama, Kanami; Sumiya, Yosuke; Takagi, Makito; Saita, Kenichiro; Maeda, SatoshiUnderstanding CO oxidation on the Pt(111) surface based on a reaction route network-Physical chemistry chemical physics-14-Jul-2019
articleYorimoto, Sadaiwa; Tsubouchi, Akira; Mizoguchi, Haruki; Oikawa, Hideaki; Tsunekawa, Yoshiaki; Ichino, Tomoya; Maeda, Satoshi; Oguri, HirokiZn(OTf)(2)-mediated annulations of N-propargylated tetrahydrocarbolines: divergent synthesis of four distinct alkaloidal scaffolds-Chemical science-14-Jun-2019
article (author version)Tsutsumi, Takuro; Harabuchi, Yu; Ono, Yuriko; Maeda, Satoshi; Taketsugu, TetsuyaAnalyses of trajectory on-the-fly based on the global reaction route map-Physical chemistry chemical physics-21-Jan-2018
articleYoshimura, Takayoshi; Maeda, Satoshi; Taketsugu, Tetsuya; Sawamura, Masaya; Morokuma, Keiji; Mori, SeijiExploring the full catalytic cycle of rhodium(I)BINAP-catalysed isomerisation of allylic amines : a graph theory approach for path optimisation-Chemical science-Jun-2017
articleTakagi, Makito; Taketsugu, Tetsuya; Kino, Hiori; Tateyama, Yoshitaka; Terakura, Kiyoyuki; Maeda, SatoshiGlobal search for low-lying crystal structures using the artificial force induced reaction method : A case study on carbon-Physical Review B-30-May-2017
article (author version)Harabuchi, Yu; Taketsugu, Tetsuya; Maeda, SatoshiCombined gradient projection/single component artificial force induced reaction (GP/SC-AFIR) method for an efficient search of minimum energy conical intersection (MECI) geometries-Chemical physics letters-16-Apr-2017
article (author version)Maeda, Satoshi; Harabuchi, Yu; Takagi, Makito; Taketsugu, Tetsuya; Morokuma, KeijiArtificial Force Induced Reaction (AFIR) Method for Exploring Quantum Chemical Potential Energy Surfaces-Chemical record-Oct-2016
article (author version)Saita, Kenichiro; Harabuchi, Yu; Taketsugu, Tetsuya; Ishitani, Osamu; Maeda, SatoshiTheoretical study on mechanism of the photochemical ligand substitution of fac-[Re-I(bpy)(CO)(3)(PR3)](+) complex-Physical chemistry chemical physics-14-Jul-2016
Showing results 1 to 11 of 11

 

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