publication_type publication_year number author title journal_title volume_number issue_number start_page end_page doi reported_at Paper 2024 1 Itsuki Konuma, Naohiro Ikeda, Benoît D.L. Campéon, Hinata Fujimura, Jun Kikkawa, Huu Duc Luong, Yoshitaka Tateyama, Yosuke Ugata, Masao Yonemura, Toru Ishigaki, Taira Aida, Naoaki Yabuuchi Energy Storage Materials 66 103200 https://doi.org/10.1016/j.ensm.2024.103200 2024-04-27 05:28:06 +0900 Paper 2023 1 Ryoma Sasaki, Bo Gao, Taro Hitosugi, Yoshitaka Tateyama npj Computational Materials 9 1 https://doi.org/10.1038/s41524-023-00996-8 2024-04-27 05:28:06 +0900 Paper 2023 2 Randy Jalem, Manas Likhit Holekevi Chandrappa, Ji Qi, Yoshitaka Tateyama, Shyue Ping Ong Energy Advances 2 12 2029 2041 https://doi.org/10.1039/d3ya00234a 2024-04-27 05:28:06 +0900 Paper 2023 3 Zizhen Zhou, Claudio Cazorla, Bo Gao, Huu Duc Luong, Toshiyuki Momma, Yoshitaka Tateyama ACS Applied Materials & Interfaces 15 46 53614 53622 https://doi.org/10.1021/acsami.3c14444 2024-04-27 05:28:07 +0900 Paper 2023 4 Wenchong Zhou, Chenchao Xu, Bo Gao, Masanobu Nakayama, Shunsuke Yagi, Yoshitaka Tateyama ACS Energy Letters 8 10 4113 4118 https://doi.org/10.1021/acsenergylett.3c01084 2024-04-27 05:28:07 +0900 Paper 2023 5 Randy Jalem, Yoshitaka Tateyama, Kazunori Takada, Seong-Hoon Jang The Journal of Physical Chemistry C 127 35 17307 17323 https://doi.org/10.1021/acs.jpcc.3c02801 2024-04-27 05:28:07 +0900 Paper 2023 6 Masahito Ikeda, Randy Jalem, Gen Hasegawa, Naoaki Kuwata, Qiumin Liu, Takafumi Yamamoto, Kei Shigematsu, Yoshitaka Tateyama, Masaki Azuma The Journal of Physical Chemistry C 127 29 14117 14124 https://doi.org/10.1021/acs.jpcc.3c02842 2024-04-27 05:28:07 +0900 Paper 2023 7 Yoshitaka Tateyama, Akiko Kagatsume, Masaru Yao, Shoichi Matsuda, Kohei Uosaki The Journal of Physical Chemistry C 127 27 12867 12873 https://doi.org/10.1021/acs.jpcc.3c02131 2024-04-27 05:28:07 +0900 Paper 2023 8 Seong-Hoon Jang, Randy Jalem, Yoshitaka Tateyama The Journal of Physical Chemistry A 127 27 5734 5744 https://doi.org/10.1021/acs.jpca.3c00076 2024-04-27 05:28:07 +0900 Paper 2023 9 Toshihiko Mandai, Masaru Yao, Keitaro Sodeyama, Akiko Kagatsume, Yoshitaka Tateyama, Hiroaki Imai The Journal of Physical Chemistry C 127 22 10419 10433 https://doi.org/10.1021/acs.jpcc.3c01452 2024-04-27 05:28:07 +0900 Paper 2023 10 Huu Duc Luong, Chenchao Xu, Randy Jalem, Yoshitaka Tateyama Journal of Power Sources 569 232969 https://doi.org/10.1016/j.jpowsour.2023.232969 2024-04-27 05:28:07 +0900 Paper 2023 11 F.A. Vásquez, N.C. Rosero-Navarro, R. Jalem, A. Miura, Y. Goto, Y. Tateyama, J.A. Calderón, K. Tadanaga Applied Materials Today 30 101697 https://doi.org/10.1016/j.apmt.2022.101697 2024-04-27 05:28:07 +0900 Paper 2022 1 Seong‐Hoon Jang, Yoshitaka Tateyama, Randy Jalem Advanced Functional Materials 32 48 2206036 https://doi.org/10.1002/adfm.202206036 2024-04-27 05:28:07 +0900 Paper 2022 2 Zizhen Zhou, Dewei Chu, Bo Gao, Toshiyuki Momma, Yoshitaka Tateyama, Claudio Cazorla ACS Applied Materials & Interfaces 14 32 37009 37018 https://doi.org/10.1021/acsami.2c07560 2024-04-27 05:28:07 +0900 Paper 2022 3 Atsushi Ishikawa, Fumiya Murase, Yoshitaka Tateyama, Junichiro Otomo ACS Omega 7 30 26107 26115 https://doi.org/10.1021/acsomega.2c01222 2024-04-27 05:28:07 +0900 Paper 2022 4 Bo Gao, Randy Jalem, Yoshitaka Tateyama Journal of Materials Chemistry A 10 18 10083 10091 https://doi.org/10.1039/d2ta00545j 2024-04-27 05:28:07 +0900 Paper 2022 5 Randy Jalem, Bo Gao, Hong-Kang Tian, Yoshitaka Tateyama Journal of Materials Chemistry A 10 5 2235 2248 https://doi.org/10.1039/d1ta07292g 2024-04-27 05:28:07 +0900 Paper 2022 6 Shunsuke Muto, Yuta Yamamoto, Miyuki Sakakura, Hong-Kang Tian, Yoshitaka Tateyama, Yasutoshi Iriyama STEM-EELS Spectrum Imaging of an Aerosol-Deposited NASICON-Type LATP Solid Electrolyte and LCO Cathode Interface ACS Applied Energy Materials 5 1 98 107 https://doi.org/10.1021/acsaem.1c02512 2024-04-27 05:28:07 +0900 Paper 2022 7 Shigeki Kawai, Atsushi Ishikawa, Shin‐ichiro Ishida, Takuya Yamakado, Yujing Ma, Kewei Sun, Yoshitaka Tateyama, Rémy Pawlak, Ernst Meyer, Shohei Saito, Atsuhiro Osuka On‐Surface Synthesis of Porphyrin‐Complex Multi‐Block Co‐Oligomers by Defluorinative Coupling Angewandte Chemie International Edition 61 3 https://doi.org/10.1002/anie.202114697 2024-04-27 05:28:07 +0900 Paper 2022 8 Bo Gao, Randy Jalem, Hong‐Kang Tian, Yoshitaka Tateyama "Revealing Atomic‐Scale Ionic Stability and Transport around Grain Boundaries of Garnet Li 7 La 3 Zr 2 O 12 Solid Electrolyte" Advanced Energy Materials 12 3 2102151 https://doi.org/10.1002/aenm.202102151 2024-04-27 05:28:07 +0900 Paper 2021 1 館山 佳尚 全固体電池の電極ー電解質界面のイオン・電子挙動に関する理論計算研究 応用物理 424 427 2024-04-27 05:28:07 +0900 Paper 2021 2 Shisheng Li, Jinhua Hong, Bo Gao, Yung‐Chang Lin, Hong En Lim, Xueyi Lu, Jing Wu, Song Liu, Yoshitaka Tateyama, Yoshiki Sakuma, Kazuhito Tsukagoshi, Kazu Suenaga, Takaaki Taniguchi Advanced Science 2004438-1 2004438-8 https://doi.org/10.1002/advs.202004438 2024-04-27 05:28:07 +0900 Paper 2021 3 Shogo Wakazaki, Qiumin Liu, Randy Jalem, Takumi Nishikubo, Yuki Sakai, Naoki Matsui, Guowei Zhao, Kota Suzuki, Kei Shigematsu, Takafumi Yamamoto, Ryoji Kanno, Hena Das, Yoshitaka Tateyama, Masaki Azuma High-Pressure Synthesis and Lithium-Ion Conduction of Li4OBr2 Derivatives with a Layered Inverse-Perovskite Structure Chemistry of Materials 33 23 9194 9201 https://doi.org/10.1021/acs.chemmater.1c02713 2024-04-27 05:28:07 +0900 Paper 2021 4 Yong Youn, Bo Gao, Azusa Kamiyama, Kei Kubota, Shinichi Komaba, Yoshitaka Tateyama Nanometer-size Na cluster formation in micropore of hard carbon as origin of higher-capacity Na-ion battery npj Computational Materials 7 1 https://doi.org/10.1038/s41524-021-00515-7 2024-04-27 05:28:07 +0900 Paper 2021 5 Toshihiko Mandai, Yong Youn, Yoshitaka Tateyama Remarkable electrochemical and ion-transport characteristics of magnesium-fluorinated alkoxyaluminate–diglyme electrolytes for magnesium batteries Materials Advances 2 19 6283 6296 https://doi.org/10.1039/d1ma00448d 2024-04-27 05:28:07 +0900 Paper 2021 6 Francesca Celine I. Catalan, Le The Anh, Junepyo Oh, Emiko Kazuma, Norihiko Hayazawa, Norihito Ikemiya, Naoki Kamoshida, Yoshitaka Tateyama, Yasuaki Einaga, Yousoo Kim Localized Graphitization on Diamond Surface as a Manifestation of Dopants Advanced Materials 33 42 2103250 https://doi.org/10.1002/adma.202103250 2024-04-27 05:28:07 +0900 Paper 2021 7 Shisheng Li, Yung-Chang Lin, Jinhua Hong, Bo Gao, Hong En Lim, Xu Yang, Song Liu, Yoshitaka Tateyama, Kazuhito Tsukagoshi, Yoshiki Sakuma, Kazu Suenaga, Takaaki Taniguchi Mixed-Salt Enhanced Chemical Vapor Deposition of Two-Dimensional Transition Metal Dichalcogenides Chemistry of Materials 33 18 7301 7308 https://doi.org/10.1021/acs.chemmater.1c01652 2024-04-27 05:28:07 +0900 Paper 2021 8 Randy Jalem, Yoshitaka Tateyama, Kazunori Takada, Masanobu Nakayama First-Principles DFT Study on Inverse Ruddlesden–Popper Tetragonal Compounds as Solid Electrolytes for All-Solid-State Li+-Ion Batteries Chemistry of Materials 33 15 5859 5871 https://doi.org/10.1021/acs.chemmater.1c00124 2024-04-27 05:28:07 +0900 Paper 2021 9 Le The Anh, Francesca Celine I. Catalan, Yousoo Kim, Yasuaki Einaga, Yoshitaka Tateyama Boron position-dependent surface reconstruction and electronic states of boron-doped diamond(111) surfaces: an ab initio study Physical Chemistry Chemical Physics 23 29 15628 15634 https://doi.org/10.1039/d1cp00689d 2024-04-27 05:28:07 +0900 Paper 2021 10 Hong-Kang Tian, Randy Jalem, Masaki Matsui, Toshihiko Mandai, Hidetoshi Somekawa, Yoshitaka Tateyama Tuning the performance of a Mg negative electrode through grain boundaries and alloying toward the realization of Mg batteries Journal of Materials Chemistry A 9 27 15207 15216 https://doi.org/10.1039/d1ta02419a 2024-04-27 05:28:07 +0900 Paper 2021 11 Ryoma Sasaki, Makoto Moriya, Yuki Watanabe, Kazunori Nishio, Taro Hitosugi, Yoshitaka Tateyama Peculiarly fast Li-ion conduction mechanism in a succinonitrile-based molecular crystal electrolyte: a molecular dynamics study Journal of Materials Chemistry A 9 26 14897 14903 https://doi.org/10.1039/d1ta02809j 2024-04-27 05:28:07 +0900 Paper 2021 12 Yuuki Sugawara, Keigo Kamata, Atsushi Ishikawa, Yoshitaka Tateyama, Takeo Yamaguchi Efficient Oxygen Evolution Electrocatalysis on CaFe2O4 and Its Reaction Mechanism ACS Applied Energy Materials 4 4 3057 3066 https://doi.org/10.1021/acsaem.0c02710 2024-04-27 05:28:07 +0900 Paper 2021 13 F. A. Vásquez, N. C. Rosero-Navarro, A. Miura, R. Jalem, Y. Goto, M. Nagao, Y. Tateyama, K. Tadanaga, J. A. Calderón Kinetic Control of the Li0.9Mn1.6Ni0.4O4 Spinel Structure with Enhanced Electrochemical Performance ACS Applied Materials & Interfaces 13 12 14056 14067 https://doi.org/10.1021/acsami.0c17886 2024-04-27 05:28:07 +0900 Paper 2021 14 Bo Gao, Randy Jalem, Yoshitaka Tateyama First-Principles Study of Microscopic Electrochemistry at the LiCoO2 Cathode/LiNbO3 Coating/β-Li3PS4 Solid Electrolyte Interfaces in an All-Solid-State Battery ACS Applied Materials & Interfaces 13 10 11765 11773 https://doi.org/10.1021/acsami.0c19091 2024-04-27 05:28:07 +0900 Paper 2021 15 Atsushi Ishikawa, Yoshitaka Tateyama A First-Principles Microkinetics for Homogeneous–Heterogeneous Reactions: Application to Oxidative Coupling of Methane Catalyzed by Magnesium Oxide ACS Catalysis 11 5 2691 2700 https://doi.org/10.1021/acscatal.0c04104 2024-04-27 05:28:07 +0900 Paper 2021 16 Atsushi Ishikawa, Yoshitaka Tateyama Hybrid Functional Study of H-Abstraction from Methane by Li-Doped, Pristine and Stepped MgO(100) and MgO(110) Surfaces Catalysis Letters 151 3 627 633 https://doi.org/10.1007/s10562-020-03358-x 2024-04-27 05:28:07 +0900 Paper 2021 17 Azusa Kamiyama, Kei Kubota, Daisuke Igarashi, Yong Youn, Yoshitaka Tateyama, Hideka Ando, Kazuma Gotoh, Shinichi Komaba MgO‐Template Synthesis of Extremely High Capacity Hard Carbon for Na‐Ion Battery Angewandte Chemie International Edition 60 10 5114 5120 https://doi.org/10.1002/anie.202013951 2024-04-27 05:28:07 +0900 Paper 2021 18 Marcela Calpa, Nataly Carolina Rosero-Navarro, Akira Miura, Randy Jalem, Yoshitaka Tateyama, Kiyoharu Tadanaga Chemical stability of Li4PS4I solid electrolyte against hydrolysis Applied Materials Today 22 100918 https://doi.org/10.1016/j.apmt.2020.100918 2024-04-27 05:28:07 +0900 Paper 2020 1 Feilure Tuerxun, Kentaro Yamamoto, Toshihiko Mandai, Yoshitaka Tateyama, Koji Nakanishi, Tomoki Uchiyama, Toshiki Watanabe, Yusuke Tamenori, Kiyoshi Kanamura, Yoshiharu Uchimoto Effect of Interaction among Magnesium Ions, Anion, and Solvent on Kinetics of the Magnesium Deposition Process The Journal of Physical Chemistry C 124 52 28510 28519 https://doi.org/10.1021/acs.jpcc.0c08268 2024-04-27 05:28:07 +0900 Paper 2020 2 Hong-Kang Tian, Randy Jalem, Bo Gao, Yuta Yamamoto, Shunsuke Muto, Miyuki Sakakura, Yasutoshi Iriyama, Yoshitaka Tateyama Electron and Ion Transfer across Interfaces of the NASICON-Type LATP Solid Electrolyte with Electrodes in All-Solid-State Batteries: A Density Functional Theory Study via an Explicit Interface Model ACS Applied Materials & Interfaces 12 49 54752 54762 https://doi.org/10.1021/acsami.0c16463 2024-04-27 05:28:07 +0900 Paper 2020 3 Yukihiro Okuno, Jun Haruyama, Yoshitaka Tateyama Comparative Study on Sulfide and Oxide Electrolyte Interfaces with Cathodes in All-Solid-State Battery via First-Principles Calculations ACS Applied Energy Materials 3 11 11061 11072 https://doi.org/10.1021/acsaem.0c02033 2024-04-27 05:28:07 +0900 Paper 2020 4 Randy Jalem, Akitoshi Hayashi, Fumika Tsuji, Atsushi Sakuda, Yoshitaka Tateyama First-Principles Calculation Study of Na+ Superionic Conduction Mechanism in W- and Mo-Doped Na3SbS4 Solid Electrolytes Chemistry of Materials 32 19 8373 8381 https://doi.org/10.1021/acs.chemmater.0c02318 2024-04-27 05:28:07 +0900 Paper 2020 5 Kasumi Miyazaki, Norio Takenaka, Eriko Watanabe, Yuki Yamada, Yoshitaka Tateyama, Atsuo Yamada First-Principles Study on the Cation-Dependent Electrochemical Stabilities in Li/Na/K Hydrate-Melt Electrolytes ACS Applied Materials & Interfaces 12 38 42734 42738 https://doi.org/10.1021/acsami.0c10472 2024-04-27 05:28:07 +0900 Paper 2020 6 Nataly Carolina Rosero-Navarro, Ryunosuke Kajiura, Randy Jalem, Yoshitaka Tateyama, Akira Miura, Kiyoharu Tadanaga Significant Reduction in the Interfacial Resistance of Garnet-Type Solid Electrolyte and Lithium Metal by a Thick Amorphous Lithium Silicate Layer ACS Applied Energy Materials 3 6 5533 5541 https://doi.org/10.1021/acsaem.0c00511 2024-04-27 05:28:07 +0900 Paper 2020 7 Feilure Tuerxun, Kentaro Yamamoto, Masashi Hattori, Toshihiko Mandai, Koji Nakanishi, Ashu Choudhary, Yoshitaka Tateyama, Keitaro Sodeyama, Aiko Nakao, Tomoki Uchiyama, Masaki Matsui, Kazuki Tsuruta, Yusuke Tamenori, Kiyoshi Kanamura, Yoshiharu Uchimoto Determining Factor on the Polarization Behavior of Magnesium Deposition for Magnesium Battery Anode ACS Applied Materials & Interfaces 12 23 25775 25785 https://doi.org/10.1021/acsami.0c03696 2024-04-27 05:28:07 +0900 Paper 2020 8 Takeshi Baba, Keitaro Sodeyama, Yoshiumi Kawamura, Yoshitaka Tateyama Li-ion transport at the interface between a graphite anode and Li2CO3 solid electrolyte interphase: ab initio molecular dynamics study Physical Chemistry Chemical Physics 22 19 10764 10774 https://doi.org/10.1039/c9cp06608j 2024-04-27 05:28:07 +0900 Paper 2020 9 Bo Gao, Randy Jalem, Yoshitaka Tateyama Surface-Dependent Stability of the Interface between Garnet Li7La3Zr2O12 and the Li Metal in the All-Solid-State Battery from First-Principles Calculations ACS Applied Materials & Interfaces 12 14 16350 16358 https://doi.org/10.1021/acsami.9b23019 2024-04-27 05:28:07 +0900 Paper 2020 10 Atsushi Ishikawa, Yoshitaka Tateyama What Is the Active Site for the Oxidative Coupling of Methane Catalyzed by MgO? A Metadynamics-Biased Ab Initio Molecular Dynamics Study The Journal of Physical Chemistry C 124 11 6054 6062 https://doi.org/10.1021/acs.jpcc.9b09959 2024-04-27 05:28:07 +0900 Paper 2020 11 Bo Gao, Randy Jalem, Yanming Ma, Yoshitaka Tateyama Li+ Transport Mechanism at the Heterogeneous Cathode/Solid Electrolyte Interface in an All-Solid-State Battery via the First-Principles Structure Prediction Scheme Chemistry of Materials 32 1 85 96 https://doi.org/10.1021/acs.chemmater.9b02311 2024-04-27 05:28:07 +0900 Paper 2020 12 M. H. N. Assadi, Masashi Okubo, Atsuo Yamada, Yoshitaka Tateyama "Possible high-potential ilmenite type Na1MO3 (M=V–Ni) cathodes realized by dominant oxygen redox reaction" Physical Review Materials 4 1 https://doi.org/10.1103/physrevmaterials.4.015401 2024-04-27 05:28:07 +0900 Paper 2019 1 館山 佳尚 ヘテロ固固界面現象の第一原理計算アプローチ:全固体電池界面解析に向けて CERAMICS JAPAN 481 484 2024-04-27 05:28:07 +0900 Paper 2019 2 館山 佳尚 リチウムイオン電池 Solid Electrolyte Interphase (SEI) に関する第一原理計算研究 Journal of Computer Chemistry, Japan 18 1 18 28 https://doi.org/10.2477/jccj.2018-0046 2024-04-27 05:28:07 +0900 Paper 2019 3 Atsushi Ishikawa, Keitaro Sodeyama, Yasuhiko Igarashi, Tomofumi Nakayama, Yoshitaka Tateyama, Masato Okada Machine learning prediction of coordination energies for alkali group elements in battery electrolyte solvents Physical Chemistry Chemical Physics 21 48 26399 26405 https://doi.org/10.1039/c9cp03679b 2024-04-27 05:28:07 +0900 Paper 2019 4 Takao Tsuneda, Yoshitaka Tateyama On principal features of organic electrolyte molecules in lithium ion battery performance Physical Chemistry Chemical Physics 21 41 22990 22998 https://doi.org/10.1039/c9cp03980e 2024-04-27 05:28:07 +0900 Paper 2019 5 Kasumi Miyazaki, Norio Takenaka, Eriko Watanabe, Shota Iizuka, Yuki Yamada, Yoshitaka Tateyama, Atsuo Yamada First-Principles Study on the Peculiar Water Environment in a Hydrate-Melt Electrolyte The Journal of Physical Chemistry Letters 10 20 6301 6305 https://doi.org/10.1021/acs.jpclett.9b02207 2024-04-27 05:28:07 +0900 Paper 2019 6 Yoshitaka Tateyama, Bo Gao, Randy Jalem, Jun Haruyama Theoretical picture of positive electrode–solid electrolyte interface in all-solid-state battery from electrochemistry and semiconductor physics viewpoints Current Opinion in Electrochemistry 17 149 157 https://doi.org/10.1016/j.coelec.2019.06.003 2024-04-27 05:28:07 +0900 Paper 2019 7 Atsushi Ishikawa, Yoshitaka Tateyama Reaction energy benchmarks of hydrocarbon combustion by Gaussian basis and plane wave basis approaches Journal of Computational Chemistry 40 20 1866 1873 https://doi.org/10.1002/jcc.25838 2024-04-27 05:28:07 +0900 Paper 2019 8 Chizu Yamaguchi, Keisuke Natsui, Shota Iizuka, Yoshitaka Tateyama, Yasuaki Einaga Electrochemical properties of fluorinated boron-doped diamond electrodes via fluorine-containing plasma treatment Physical Chemistry Chemical Physics 21 25 13788 13794 https://doi.org/10.1039/c8cp07402j 2024-04-27 05:28:07 +0900 Paper 2019 9 Toshihiko Mandai, Kenji Tatesaka, Kenya Soh, Hyuma Masu, Ashu Choudhary, Yoshitaka Tateyama, Ryuta Ise, Hiroaki Imai, Tatsuya Takeguchi, Kiyoshi Kanamura Modifications in coordination structure of Mg[TFSA]2-based supporting salts for high-voltage magnesium rechargeable batteries Physical Chemistry Chemical Physics 21 23 12100 12111 https://doi.org/10.1039/c9cp01400d 2024-04-27 05:28:07 +0900 Paper 2019 10 Seiji Kasahara, Taiga Ogose, Norihito Ikemiya, Takashi Yamamoto, Keisuke Natsui, Yasuyuki Yokota, Raymond A. Wong, Shota Iizuka, Nagahiro Hoshi, Yoshitaka Tateyama, Yousoo Kim, Masashi Nakamura, Yasuaki Einaga In Situ Spectroscopic Study on the Surface Hydroxylation of Diamond Electrodes Analytical Chemistry 91 8 4980 4986 https://doi.org/10.1021/acs.analchem.8b03834 2024-04-27 05:28:07 +0900 Paper 2019 11 Tribidasari A. Ivandini, Takeshi Watanabe, Takahiro Matsui, Yusuke Ootani, Shota Iizuka, Ryo Toyoshima, Hideyuki Kodama, Hiroshi Kondoh, Yoshitaka Tateyama, Yasuaki Einaga Influence of Surface Orientation on Electrochemical Properties of Boron-Doped Diamond The Journal of Physical Chemistry C 123 9 5336 5344 https://doi.org/10.1021/acs.jpcc.8b10406 2024-04-27 05:28:07 +0900 Paper 2019 12 Yukihiro Okuno, Keisuke Ushirogata, Keitaro Sodeyama, Ganes Shukri, Yoshitaka Tateyama Structures, Electronic States, and Reactions at Interfaces between LiNi0.5Mn1.5O4 Cathode and Ethylene Carbonate Electrolyte: A First-Principles Study The Journal of Physical Chemistry C 123 4 2267 2277 https://doi.org/10.1021/acs.jpcc.8b10625 2024-04-27 05:28:07 +0900 Paper 2019 13 M. H. N. Assadi, Masashi Okubo, Atsuo Yamada, Yoshitaka Tateyama Oxygen Redox Promoted by Na Excess and Covalency in Hexagonal and Monoclinic Na2−xRuO3 Polymorphs Journal of The Electrochemical Society 166 3 A5343 A5348 https://doi.org/10.1149/2.0521903jes 2024-04-27 05:28:07 +0900 Paper 2018 1 館山佳尚 カー・パリネロ分子動力学(CPMD)ワークショップ 固体物理 7 401 406 2024-04-27 05:28:07 +0900 Paper 2018 2 館山佳尚 ホウ素ドープダイヤモンド電極界面反応の理論計算 NEW DIAMOND 2 13 15 2024-04-27 05:28:07 +0900 Paper 2018 3 Randy Jalem, Masanobu Nakayama, Yusuke Noda, Tam Le, Ichiro Takeuchi, Yoshitaka Tateyama, Hisatsugu Yamazaki A general representation scheme for crystalline solids based on Voronoi-tessellation real feature values and atomic property data Science and Technology of Advanced Materials 19 1 231 242 https://doi.org/10.1080/14686996.2018.1439253 2024-04-27 05:28:07 +0900 Paper 2018 4 Lucie Szabová, Matteo Farnesi Camellone, Fabio Negreiros Ribeiro, Vladimír Matolín, Yoshitaka Tateyama, Stefano Fabris Dynamical Solvent Effects on the Charge and Reactivity of Ceria-Supported Pt Nanoclusters The Journal of Physical Chemistry C 122 48 27507 27515 https://doi.org/10.1021/acs.jpcc.8b09154 2024-04-27 05:28:07 +0900 Paper 2018 5 Masashi Hattori, Kentaro Yamamoto, Masaki Matsui, Koji Nakanishi, Toshihiko Mandai, Ashu Choudhary, Yoshitaka Tateyama, Keitaro Sodeyama, Tomoki Uchiyama, Yuki Orikasa, Yusuke Tamenori, Tatsuya Takeguchi, Kiyoshi Kanamura, Yoshiharu Uchimoto Role of Coordination Structure of Magnesium Ions on Charge and Discharge Behavior of Magnesium Alloy Electrode The Journal of Physical Chemistry C 122 44 25204 25210 https://doi.org/10.1021/acs.jpcc.8b08558 2024-04-27 05:28:07 +0900 Paper 2018 6 Atsushi Ishikawa, Yoshitaka Tateyama First-Principles Microkinetic Analysis of NO + CO Reactions on Rh(111) Surface toward Understanding NOx Reduction Pathways The Journal of Physical Chemistry C 122 30 17378 17388 https://doi.org/10.1021/acs.jpcc.8b05906 2024-04-27 05:28:07 +0900 Paper 2018 7 Filip Dvořák, Lucie Szabová, Viktor Johánek, Matteo Farnesi Camellone, Vitalii Stetsovych, Mykhailo Vorokhta, Andrii Tovt, Tomáš Skála, Iva Matolínová, Yoshitaka Tateyama, Josef Mysliveček, Stefano Fabris, Vladimír Matolín Bulk Hydroxylation and Effective Water Splitting by Highly Reduced Cerium Oxide: The Role of O Vacancy Coordination ACS Catalysis 8 5 4354 4363 https://doi.org/10.1021/acscatal.7b04409 2024-04-27 05:28:07 +0900 Paper 2018 8 M. H. N. Assadi, Masashi Okubo, Atsuo Yamada, Yoshitaka Tateyama Oxygen redox in hexagonal layered NaxTMO3 (TM = 4d elements) for high capacity Na ion batteries Journal of Materials Chemistry A 6 8 3747 3753 https://doi.org/10.1039/c7ta10826e 2024-04-27 05:28:07 +0900 Paper 2018 9 Jianhui Wang, Yuki Yamada, Keitaro Sodeyama, Eriko Watanabe, Koji Takada, Yoshitaka Tateyama, Atsuo Yamada Fire-extinguishing organic electrolytes for safe batteries Nature Energy 3 1 22 29 https://doi.org/10.1038/s41560-017-0033-8 2024-04-27 05:28:07 +0900 Paper 2017 1 Jun Haruyama, Keitaro Sodeyama, Ikutaro Hamada, Liyuan Han, Yoshitaka Tateyama First-Principles Study of Electron Injection and Defects at the TiO2/CH3NH3PbI3 Interface of Perovskite Solar Cells The Journal of Physical Chemistry Letters 8 23 5840 5847 https://doi.org/10.1021/acs.jpclett.7b02622 2024-04-27 05:28:07 +0900 Paper 2017 2 Seiji Kasahara, Keisuke Natsui, Takeshi Watanabe, Yasuyuki Yokota, Yousoo Kim, Shota Iizuka, Yoshitaka Tateyama, Yasuaki Einaga Surface Hydrogenation of Boron-Doped Diamond Electrodes by Cathodic Reduction Analytical Chemistry 89 21 11341 11347 https://doi.org/10.1021/acs.analchem.7b02129 2024-04-27 05:28:07 +0900 Paper 2017 3 館山 佳尚, 袖山 慶太郎, 後瀉敬介, 奥野幸洋 2次電池の固液界面・電解液反応の第一原理サンプリング解析 固体物理 52 11 605 615 2024-04-27 05:28:07 +0900 Paper 2017 4 Koji Takada, Yuki Yamada, Eriko Watanabe, Jianhui Wang, Keitaro Sodeyama, Yoshitaka Tateyama, Kazuhisa Hirata, Takeo Kawase, Atsuo Yamada Unusual Passivation Ability of Superconcentrated Electrolytes toward Hard Carbon Negative Electrodes in Sodium-Ion Batteries ACS Applied Materials & Interfaces 9 39 33802 33809 https://doi.org/10.1021/acsami.7b08414 2024-04-27 05:28:07 +0900 Paper 2017 5 Satoshi Kajiyama, Lucie Szabova, Hiroki Iinuma, Akira Sugahara, Kazuma Gotoh, Keitaro Sodeyama, Yoshitaka Tateyama, Masashi Okubo, Atsuo Yamada Enhanced Li-Ion Accessibility in MXene Titanium Carbide by Steric Chloride Termination Advanced Energy Materials 7 9 1601873 https://doi.org/10.1002/aenm.201601873 2024-04-27 05:28:07 +0900 Paper 2017 6 Makito Takagi, Tetsuya Taketsugu, Hiori Kino, Yoshitaka Tateyama, Kiyoyuki Terakura, Satoshi Maeda Global search for low-lying crystal structures using the artificial force induced reaction method: A case study on carbon Physical Review B 95 18 https://doi.org/10.1103/physrevb.95.184110 2024-04-27 05:28:07 +0900 Paper 2017 7 Martin Callsen, Keitaro Sodeyama, Zdeněk Futera, Yoshitaka Tateyama, Ikutaro Hamada The Solvation Structure of Lithium Ions in an Ether Based Electrolyte Solution from First-Principles Molecular Dynamics The Journal of Physical Chemistry B 121 1 180 188 https://doi.org/10.1021/acs.jpcb.6b09203 2024-04-27 05:28:07 +0900 Paper 2017 8 Jun Haruyama, Keitaro Sodeyama, Yoshitaka Tateyama Cation Mixing Properties toward Co Diffusion at the LiCoO2 Cathode/Sulfide Electrolyte Interface in a Solid-State Battery ACS Applied Materials & Interfaces 9 1 286 292 https://doi.org/10.1021/acsami.6b08435 2024-04-27 05:28:07 +0900 Paper 2016 1 Jianhui Wang, Yuki Yamada, Keitaro Sodeyama, Ching Hua Chiang, Yoshitaka Tateyama, Atsuo Yamada Superconcentrated electrolytes for a high-voltage lithium-ion battery Nature Communications 7 1 https://doi.org/10.1038/ncomms12032 2024-04-27 05:28:07 +0900 Paper 2016 2 Marco Fronzi, Yoshitaka Tateyama, Nicola Marzari, Michael Nolan, Enrico Traversa First-principles molecular dynamics simulations of proton diffusion in cubic BaZrO $$_3$$ 3 perovskite under strain conditions Materials for Renewable and Sustainable Energy 5 4 https://doi.org/10.1007/s40243-016-0078-9 2024-04-27 05:28:07 +0900 Paper 2016 3 Yoshiyuki Miyamoto, Yoshitaka Tateyama, Norihisa Oyama, Takahisa Ohno Conservation of the pure adiabatic state in Ehrenfest dynamics of the photoisomerization of molecules Scientific Reports 5 1 https://doi.org/10.1038/srep18220 2024-04-27 05:28:07 +0900 Paper 2016 4 Takeshi Kashiwada, Takeshi Watanabe, Yusuke Ootani, Yoshitaka Tateyama, Yasuaki Einaga A Study on Electrolytic Corrosion of Boron-Doped Diamond Electrodes when Decomposing Organic Compounds ACS Applied Materials & Interfaces 8 42 28299 28305 https://doi.org/10.1021/acsami.5b11638 2024-04-27 05:28:07 +0900 Paper 2016 5 Yuki Yamada, Kenji Usui, Keitaro Sodeyama, Seongjae Ko, Yoshitaka Tateyama, Atsuo Yamada Hydrate-melt electrolytes for high-energy-density aqueous batteries Nature Energy 1 10 https://doi.org/10.1038/nenergy.2016.129 2024-04-27 05:28:07 +0900 Paper 2016 6 Matteo Farnesi Camellone, Fabio Negreiros Ribeiro, Lucie Szabová, Yoshitaka Tateyama, Stefano Fabris Catalytic Proton Dynamics at the Water/Solid Interface of CeriaSupported Pt Clusters Journal of the American Chemical Society 138 36 11560 11567 https://doi.org/10.1021/jacs.6b03446 2024-04-27 05:28:07 +0900 Paper 2016 7 Yusuke Ootani, Keitaro Sodeyama, Liyuan Han, Yoshitaka Tateyama First-principles study on the cosensitization effects of Ru and squaraine dyes on a TiO2 surface Surface Science 649 66 71 https://doi.org/10.1016/j.susc.2016.01.025 2024-04-27 05:28:07 +0900 Paper 2016 8 Satoshi Kajiyama, Lucie Szabova, Keitaro Sodeyama, Hiroki Iinuma, Ryohei Morita, Kazuma Gotoh, Yoshitaka Tateyama, Masashi Okubo, Atsuo Yamada Sodium-Ion Intercalation Mechanism in MXene Nanosheets ACS Nano 10 3 3334 3341 https://doi.org/10.1021/acsnano.5b06958 2024-04-27 05:28:07 +0900 Paper 2016 9 Jun Haruyama, Keitaro Sodeyama, Liyuan Han, Yoshitaka Tateyama Surface Properties of CH3NH3PbI3 for Perovskite Solar Cells Accounts of Chemical Research 49 3 554 561 https://doi.org/10.1021/acs.accounts.5b00452 2024-04-27 05:28:07 +0900 Paper 2016 10 Yukihiro Okuno, Keisuke Ushirogata, Keitaro Sodeyama, Yoshitaka Tateyama Decomposition of the fluoroethylene carbonate additive and the glue effect of lithium fluoride products for the solid electrolyte interphase: an ab initio study Physical Chemistry Chemical Physics 18 12 8643 8653 https://doi.org/10.1039/c5cp07583a 2024-04-27 05:28:07 +0900 Paper 2016 11 J. Scheers, D. Lidberg, K. Sodeyama, Z. Futera, Y. Tateyama Life of superoxide in aprotic Li–O2 battery electrolytes: simulated solvent and counter-ion effects Physical Chemistry Chemical Physics 18 15 9961 9968 https://doi.org/10.1039/c5cp08056h 2024-04-27 05:28:07 +0900 Paper 2015 1 Yuki Yamada, Ching Hua Chiang, Keitaro Sodeyama, Jianhui Wang, Yoshitaka Tateyama, Atsuo Yamada Corrosion Prevention Mechanism of Aluminum Metal in Superconcentrated Electrolytes ChemElectroChem 2 11 1687 1694 https://doi.org/10.1002/celc.201500235 2024-04-27 05:28:07 +0900 Paper 2015 2 Takeo Ohsawa, Shigenori Ueda, Motohiro Suzuki, Yoshitaka Tateyama, Jesse R. Williams, Naoki Ohashi Investigating crystalline-polarity-dependent electronic structures of GaN by hard x-ray photoemission and ab-initio calculations Applied Physics Letters 107 17 171604 https://doi.org/10.1063/1.4934842 2024-04-27 05:28:07 +0900 Paper 2015 3 Keisuke Ushirogata, Keitaro Sodeyama, Zdenek Futera, Yoshitaka Tateyama, Yukihiro Okuno Near-Shore Aggregation Mechanism of Electrolyte Decomposition Products to Explain Solid Electrolyte Interphase Formation Journal of The Electrochemical Society 162 14 A2670 A2678 https://doi.org/10.1149/2.0301514jes 2024-04-27 05:28:07 +0900 Paper 2015 4 Ryota Jono, Yoshitaka Tateyama, Koichi Yamashita A method to calculate redox potentials relative to the normal hydrogen electrode in nonaqueous solution by using density functional theory-based molecular dynamics Physical Chemistry Chemical Physics 17 40 27103 27108 https://doi.org/10.1039/c5cp05029d 2024-04-27 05:28:07 +0900 Paper 2015 5 Jun Haruyama, Keitaro Sodeyama, Liyuan Han, Yoshitaka Tateyama First-Principles Study of Ion Diffusion in Perovskite Solar Cell Sensitizers Journal of the American Chemical Society 137 32 10048 10051 https://doi.org/10.1021/jacs.5b03615 2024-04-27 05:28:07 +0900 Paper 2015 6 Kazunori Takada, Narumi Ohta, Yoshitaka Tateyama Recent progress in interfacial nanoarchitectonics in solid-state batteries Journal of Inorganic and Organometallic Polymers and Materials 25 2 205 213 https://doi.org/10.1007/s10904-014-0127-8 2024-04-27 05:28:07 +0900 Paper 2015 7 Lucie Szabová, Yoshitaka Tateyama, Vladimír Matolín, Stefano Fabris Water Adsorption and Dissociation at Metal-Supported Ceria Thin Films: Thickness and Interface-Proximity Effects Studied with DFT+U Calculations The Journal of Physical Chemistry C 119 5 2537 2544 https://doi.org/10.1021/jp5109152 2024-04-27 05:28:07 +0900 Paper 2015 8 Yusuke Ootani, Keitaro Sodeyama, Liyuan Han, Yoshitaka Tateyama Possibility of NCS Group Anchor for Ru Dye Adsorption to Anatase TiO2(101) Surface: A Density Functional Theory Investigatioin The Journal of Physical Chemistry C 119 1 234 241 https://doi.org/10.1021/jp5075434 2024-04-27 05:28:07 +0900 Paper 2014 1 Zdenek Futera, Takeshi Watanabe, Yasuaki Einaga, Yoshitaka Tateyama First Principles Calculation Study on Surfaces and Water Interfaces of Boron-Doped Diamond The Journal of Physical Chemistry C 118 38 22040 22052 https://doi.org/10.1021/jp506046m 2024-04-27 05:28:07 +0900 Paper 2014 2 Jun Haruyama, Keitaro Sodeyama, Liyuan Han, Yoshitaka Tateyama Termination Dependence of Tetragonal CH3NH3PbI3 Surfaces for Perovskite Solar Cells The Journal of Physical Chemistry Letters 5 16 2903 2909 https://doi.org/10.1021/jz501510v 2024-04-27 05:28:07 +0900 Paper 2014 3 Zdenek Futera, Keitaro Sodeyama, Jaroslav V. Burda, Yasuaki Einaga, Yoshitaka Tateyama A double-QM/MM method for investigating donor–acceptor electron-transfer reactions in solution Phys. Chem. Chem. Phys. 16 36 19530 19539 https://doi.org/10.1039/c4cp02307b 2024-04-27 05:28:07 +0900 Paper 2014 4 Yoshitaka Tateyama, Masato Sumita, Yusuke Ootani, Koharu Aikawa, Ryota Jono, Liyuan Han, Keitaro Sodeyama Acetonitrile Solution Effect on Ru N749 Dye Adsorption and Excitation at TiO2 Anatase Interface The Journal of Physical Chemistry C 118 30 16863 16871 https://doi.org/10.1021/jp5004006 2024-04-27 05:28:07 +0900 Paper 2014 5 Jun Haruyama, Keitaro Sodeyama, Liyuan Han, Kazunori Takada, Yoshitaka Tateyama Space–Charge Layer Effect at Interface between Oxide Cathode and Sulfide Electrolyte in All-Solid-State Lithium-Ion Battery Chemistry of Materials 26 14 4248 4255 https://doi.org/10.1021/cm5016959 2024-04-27 05:28:07 +0900 Paper 2014 6 Keitaro Sodeyama, Yuki Yamada, Koharu Aikawa, Atsuo Yamada, Yoshitaka Tateyama Sacrificial anion reduction mechanism for electrochemical stability improvement in highly concentrated Li-salt electrolyte The Journal of Physical Chemistry C 118 26 14091 14097 https://doi.org/10.1021/jp501178n 2024-04-27 05:28:07 +0900 Paper 2014 7 Wim Van Rossom, Tatyana G. Terentyeva, Keitaro Sodeyama, Yoshitaka Matsushita, Yoshitaka Tateyama, Katsuhiko Ariga, Jonathan P. Hill Arylpyrrole oligomers as tunable anion receptors Org. Biomol. Chem. 12 29 5492 5499 https://doi.org/10.1039/c4ob00357h 2024-04-27 05:28:07 +0900 Paper 2014 8 Yuki Yamada, Keizo Furukawa, Keitaro Sodeyama, Keisuke Kikuchi, Makoto Yaegashi, Yoshitaka Tateyama, Atsuo Yamada Unusual Stability of Acetonitrile-Based Superconcentrated Electrolytes for Fast-Charging Lithium-Ion Batteries Journal of the American Chemical Society 136 13 5039 5046 https://doi.org/10.1021/ja412807w 2024-04-27 05:28:07 +0900 Paper 2014 9 Jan Labuta, Zdenek Futera, Shinsuke Ishihara, Hana Kouřilová, Yoshitaka Tateyama, Katsuhiko Ariga, Jonathan P. Hill Chiral Guest Binding as a Probe of Macrocycle Dynamics and Tautomerism in a Conjugated Tetrapyrrole Journal of the American Chemical Society 136 5 2112 2118 https://doi.org/10.1021/ja4124175 2024-04-27 05:28:07 +0900 Paper 2013 1 Hiroyoshi Momida, Yusuke Asari, Yoshimichi Nakamura, Yoshitaka Tateyama, Takahisa Ohno Hydrogen-enhanced vacancy embrittlement of grain boundaries in iron Physical Review B 88 14 https://doi.org/10.1103/physrevb.88.144107 2024-04-27 05:28:07 +0900 Paper 2013 2 Tomoki Kobori, Keitaro Sodeyama, Takao Otsuka, Yoshitaka Tateyama, Shinji Tsuneyuki Trimer effects in fragment molecular orbital-linear combination of molecular orbitals calculation of one-electron orbitals for biomolecules The Journal of Chemical Physics 139 9 094113 https://doi.org/10.1063/1.4818599 2024-04-27 05:28:07 +0900 Paper 2013 3 Keisuke Ushirogata, Keitaro Sodeyama, Yukihiro Okuno, Yoshitaka Tateyama Additive Effect on Reductive Decomposition and Binding of Carbonate-Based Solvent toward Solid Electrolyte Interphase Formation in Lithium-Ion Battery Journal of the American Chemical Society 135 32 11967 11974 https://doi.org/10.1021/ja405079s 2024-04-27 05:28:07 +0900 Paper 2013 4 Chuanjiang Qin, Youhei Numata, Shufang Zhang, Ashraful Islam, Xudong Yang, Keitaro Sodeyama, Yoshitaka Tateyama, Liyuan Han A Near-Infraredcis-Configured Squaraine Co-Sensitizer for High-Efficiency Dye-Sensitized Solar Cells Advanced Functional Materials 23 30 3782 3789 https://doi.org/10.1002/adfm.201203384 2024-04-27 05:28:07 +0900 Paper 2013 5 Youhei Numata, Ashraful Islam, Keitaro Sodeyama, Zhen-Hua Chen, Yoshitaka Tateyama, Liyuan Han 色素増感太陽電池におけるキャリア輸送特性に及ぼすRu-ピリジル錯体の効果 Journal of Materials Chemistry A 1 36 11033 https://doi.org/10.1039/c3ta12152f 2024-04-27 05:28:07 +0900 Paper 2013 6 Greg Pawin, Adam Z. Stieg, Catherine Skibo, Maricarmen Grisolia, Reto R. Schilittler, Véronique Langlais, Yoshitaka Tateyama, Christian Joachim, James K. Gimzewski Amplification of Conformational Effects via tert-Butyl Groups: Hexa-tert-butyl decacyclene on Cu(100) at Room Temperature Langmuir 29 24 7309 7317 https://doi.org/10.1021/la304634n 2024-04-27 05:28:07 +0900 Paper 2013 7 Yu Seok Yang, Takuma Yasuda, Hayato Kakizoe, Hiroyuki Mieno, Hiori Kino, Yoshitaka Tateyama, Chihaya Adachi High performance organic field-effect transistors based on single-crystal microribbons and microsheets of solution-processed dithieno[3,2-b:2′,3′-d]thiophene derivatives Chemical Communications 49 58 6483 https://doi.org/10.1039/c3cc42114g 2024-04-27 05:28:07 +0900 Paper 2013 8 Fengxia Geng, Renzhi Ma, Akira Nakamura, Kosho Akatsuka, Yasuo Ebina, Yusuke Yamauchi, Nobuyoshi Miyamoto, Yoshitaka Tateyama, Takayoshi Sasaki Unusually stable ~100-fold reversible and instantaneous swelling of inorganic layered materials Nature Communications 4 1 https://doi.org/10.1038/ncomms2641 2024-04-27 05:28:07 +0900 Paper 2013 9 Yasuhiro Kosaki, Hironori Izawa, Shinsuke Ishihara, Kohsaku Kawakami, Masato Sumita, Yoshitaka Tateyama, Qingmin Ji, Venkata Krishnan, Shunichi Hishita, Yusuke Yamauchi, Jonathan P. Hill, Ajayan Vinu, Seimei Shiratori, Katsuhiko Ariga Nanoporous Carbon Sensor with Cage-in-Fiber Structure: Highly Selective Aniline Adsorbent toward Cancer Risk Management ACS Applied Materials & Interfaces 5 8 2930 2934 https://doi.org/10.1021/am400940q 2024-04-27 05:28:07 +0900 Paper 2013 10 Taizo Mori, Masaaki Akamatsu, Ken Okamoto, Masato Sumita, Yoshitaka Tateyama, Hideki Sakai, Jonathan P Hill, Masahiko Abe, Katsuhiko Ariga Micrometer-level Naked-eye Detection of Caesium Particulates in the Solid State Science and Technology of Advanced Materials 14 1 015002 https://doi.org/10.1088/1468-6996/14/1/015002 2024-04-27 05:28:07 +0900 Paper 2013 11 Hironori Izawa, Kohsaku Kawakami, Masato Sumita, Yoshitaka Tateyama, Jonathan P. Hill, Katsuhiko Ariga β-Cyclodextrin-crosslinked alginate gel for patient-controlled drug delivery systems: regulation of host–guest interactions with mechanical stimuli Journal of Materials Chemistry B 1 16 2155 https://doi.org/10.1039/c3tb00503h 2024-04-27 05:28:07 +0900 Paper 2013 12 Masato Sumita, Keitaro Sodeyama, Ryota Jono, Liyuan Han, Yoshitaka Tateyama Electronic structure of acetonitrile adsorbed on the anatase TiO2 (101) surface Chemical Physics Letters 556 225 229 https://doi.org/10.1016/j.cplett.2012.11.060 2024-04-27 05:28:07 +0900 Paper 2012 1 Ryota Jono, Masato Sumita, Yoshitaka Tateyama, Koichi Yamashita Redox Reaction Mechanisms with Non-triiodide Mediators in Dye-Sensitized Solar Cells by Redox Potential Calculations The Journal of Physical Chemistry Letters 3 23 3581 3584 https://doi.org/10.1021/jz301589a 2024-04-27 05:28:07 +0900 Paper 2012 2 Marco Fronzi, Silvia Cereda, Yoshitaka Tateyama, Alessandro De Vita, Enrico Traversa Physical Review B 86 8 https://doi.org/10.1103/physrevb.86.085407 2024-04-27 05:28:07 +0900 Paper 2012 3 館山 佳尚 第一原理計算による光触媒系TiO2/H2O界面の原子スケール解析 表面科学 33 6 345 350 2024-04-27 05:28:07 +0900 Paper 2012 4 Kun Zhang, Shufang Zhang, Keitaro Sodeyama, Xudong Yang, Han Chen, Masatoshi Yanagida, Yoshitaka Tateyama, Liyuan Han A New Factor Affecting the Performance of Dye-Sensitized Solar Cells in the Presence of 4-tert-Butylpyridine Applied Physics Express 5 4 042303 https://doi.org/10.1143/apex.5.042303 2024-04-27 05:28:07 +0900 Paper 2012 5 Keitaro Sodeyama, Masato Sumita, Conn O’Rourke, Umberto Terranova, Ashraful Islam, Liyuan Han, David R. Bowler, Yoshitaka Tateyama N749ルテニウム色素(ブラックダイ)の二酸化チタンアナターゼ(101)表面における吸着:プロト ンを有するカルボキシル基による安定吸着構造 The Journal of Physical Chemistry Letters 3 4 472 477 https://doi.org/10.1021/jz201583n 2024-04-27 05:28:07 +0900 Paper 2011 1 Masato Sumita, Keitaro Sodeyama, Liyuan Han, Yoshitaka Tateyama Water Contamination Effect on Liquid Acetonitrile/TiO2 Anatase (101) Interface for Durable Dye-Sensitized Solar Cell The Journal of Physical Chemistry C 115 40 19849 19855 https://doi.org/10.1021/jp206910f 2024-04-27 05:28:07 +0900 Paper 2011 2 Masato Sumita, Kazuya Saito, Yoshitaka Tateyama Computational study on photo- and thermo-reactions between tetra-tert-butyl-substituted cyclobutadiene and tetrahedrane Computational and Theoretical Chemistry 969 1-3 44 52 https://doi.org/10.1016/j.comptc.2011.05.011 2024-04-27 05:28:07 +0900 Paper 2011 3 Yuji Okawa, Swapan K. Mandal, Chunping Hu, Yoshitaka Tateyama, Stefan Goedecker, Shigeru Tsukamoto, Tsuyoshi Hasegawa, James K. Gimzewski, Masakazu Aono 分子エレクトロニクス回路を目指したケミカルワイアリング・ソルダリング Journal of the American Chemical Society 133 21 8227 8233 https://doi.org/10.1021/ja111673x 2024-04-27 05:28:07 +0900 Paper 2011 4 Jinghua Li, Zdenek Futera, Hongfang Li, Yoshitaka Tateyama, Masayoshi Higuchi Conjugation of organic-metallic hybrid polymers and calf-thymus DNA Physical Chemistry Chemical Physics 13 11 4839 https://doi.org/10.1039/c0cp02037k 2024-04-27 05:28:07 +0900 Paper 2010 1 Chunping Hu, Osamu Sugino, Hirotoshi Hirai, Yoshitaka Tateyama Nonadiabatic couplings from the Kohn-Sham derivative matrix: Formulation by time-dependent density-functional theory and evaluation in the pseudopotential framework Physical Review A 82 6 https://doi.org/10.1103/physreva.82.062508 2024-04-27 05:28:07 +0900 Paper 2010 2 Masato Sumita, Chunping Hu, Yoshitaka Tateyama Interface Water on TiO2 Anatase (101) and (001) Surfaces: First-Principles Study with TiO2 Slabs Dipped in Bulk Water The Journal of Physical Chemistry C 114 43 18529 18537 https://doi.org/10.1021/jp105364z 2024-04-27 05:28:07 +0900 Paper 2010 3 Liang Wang, Chunping Hu, Yoshihiro Nemoto, Yoshitaka Tateyama, Yusuke Yamauchi On the Role of Ascorbic Acid in the Synthesis of Single-Crystal Hyperbranched Platinum Nanostructures Crystal Growth & Design 10 8 3454 3460 https://doi.org/10.1021/cg100207q 2024-04-27 05:28:07 +0900 Paper 2010 4 Takeshi Watanabe, Tomoko K. Shimizu, Yoshitaka Tateyama, Yousoo Kim, Maki Kawai, Yasuaki Einaga Giant electric double-layer capacitance of heavily boron-doped diamond electrode Diamond and Related Materials 19 7-9 772 777 https://doi.org/10.1016/j.diamond.2010.02.022 2024-04-27 05:28:07 +0900 Paper 2010 5 館山 佳尚 酸化還元反応シミュレーション 金属 80 2 121 126 2024-04-27 05:28:07 +0900 Paper 2009 1 Chunping Hu, Osamu Sugino, Yoshitaka Tateyama All-electron calculation of nonadiabatic couplings from time-dependent density functional theory: Probing with the Hartree–Fock exact exchange The Journal of Chemical Physics 131 11 114101 https://doi.org/10.1063/1.3226344 2024-04-27 05:28:07 +0900 Paper 2009 2 Takatsugu Wakahara, Marappan Sathish, Kun’ichi Miyazawa, Chunping Hu, Yoshitaka Tateyama, Yoshihiro Nemoto, Toshio Sasaki, Osamu Ito C60/Fcナノシートの合成と光学特性、フラーレンシートの大量合成 Journal of the American Chemical Society 131 29 9940 9944 https://doi.org/10.1021/ja901032b 2024-04-27 05:28:07 +0900 Paper 2009 3 HU, Chunping, SUGINO Osamu, TATEYAMA, Yoshitaka Calculation of atomic excitation energies by time-dependent density functional theory within modified linear response JOURNAL OF PHYSICS-CONDENSED MATTER 064229-1 064229-5 2024-04-27 05:28:07 +0900 Paper 2009 4 Hosik Lee, Yoshiyuki Miyamoto, Yoshitaka Tateyama Excited State Carbene Formation from UV irradiated Diazomethane The Journal of Organic Chemistry 74 2 562 567 https://doi.org/10.1021/jo801853h 2024-04-27 05:28:07 +0900 Paper 2008 1 N. Takahashi, Y. Nakamura, J. Nara, Y. Tateyama, T. Uda, T. Ohno Si(001) 表面初期酸化過程の理論研究 Surface Science 602 3 768 777 https://doi.org/10.1016/j.susc.2007.12.004 2024-04-27 05:28:07 +0900 Paper 2007 1 Yoshitaka Tateyama, Jochen Blumberger, Takahisa Ohno, Michiel Sprik Free energy calculation of water addition coupled to reduction of aqueous RuO-4 The Journal of Chemical Physics 126 20 204506 https://doi.org/10.1063/1.2737047 2024-04-27 05:28:07 +0900 Paper 2006 1 Yoshitaka Tateyama, Norihisa Oyama, Takahisa Ohno, Yoshiyuki Miyamoto NA The Journal of Chemical Physics 124 12 124507 https://doi.org/10.1063/1.2181139 2024-04-27 05:28:07 +0900 Paper 2005 1 Wen-Tong Geng, Arthur J. Freeman, Gregory B. Olson, Yoshitaka Tateyama, Takahisa Ohno MATERIALS TRANSACTIONS 46 4 756 760 https://doi.org/10.2320/matertrans.46.756 2024-04-27 05:28:07 +0900 Paper 2005 2 Jochen Blumberger, Yoshitaka Tateyama, Michiel Sprik Computer Physics Communications 169 1-3 256 261 https://doi.org/10.1016/j.cpc.2005.03.059 2024-04-27 05:28:07 +0900 Paper 2005 3 Yoshitaka Tateyama, Jochen Blumberger, Michiel Sprik, Ivano Tavernelli The Journal of Chemical Physics 122 23 234505 https://doi.org/10.1063/1.1938192 2024-04-27 05:28:07 +0900 Paper 2005 4 N. Takahashi, J. Nara, T. Uda, Y. Nakamura, Y. Tateyama, T. Ohno Applied Surface Science 244 1-4 190 194 https://doi.org/10.1016/j.apsusc.2004.09.138 2024-04-27 05:28:07 +0900