Tuesday, September 11 (13:00 - 14:40)
The number before P in the Presentation Number indicates whether the poster presentation is given on the 1st, 2nd, 3rd, or 4th day of the meeting.
Venue P
| 13:00-14:40 | 2P001 | Probing ultrafast electronic configuration change in an electrocyclic ring-opening reaction by time-resolved photoelectron imaging (Graduate School of Science, Kyoto Univ.) *Ryuta Uenishi, Takuya Horio, Toshinori Suzuki |
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| 13:00-14:40 | 2P002 | Temperature dependence of the hydrogen-bond structures of phenol-methanol cluster cations trapped in the temperature-variable ion trap (Graduate School of Science, Kitasato University1,School of Science, Kitasato University2) *Masataka Orito1, Keita Suzuki2, Hikaru Sato1, Yasutosi Kasahara2, Haruki Ishikawa2 |
| 13:00-14:40 | 2P003 | Microwave spectroscopy of CH3OC(O)NCO and CH3OC(O)N3 (Sophia Univ.) *Shinichiro Watanabe, Yusuke Tatsuno, Asato Machida, Yoshiyuki Kawashima, Nobuhiko Kuze |
| 13:00-14:40 | 2P004 | Construction of a many-body Ramsey interferometer of ultracold Rydberg atoms in an optical lattice (Graduate School of Science and Technology, NAIST1,Department of Photo-Molecular Science, IMS2,The Graduate University for Advanced Study, SOKENDAI3) *Kiyoharu Matsumoto1, Akira Tanaka2, Michiteru Mizoguchi2,3, Zhang Yichi2, Nobuyuki Takei2,3, Hiroyuki Katsuki1, Hisao Yanagi1, Kenji Ohmori2,3 |
| 13:00-14:40 | 2P005 | Spectroscopy of optical emissions generated by high-power pulsed magnetron sputtering (HPPMS) (Faculty of Engineering, Tokyo Polytechnic Univ.1,Ayabo Corp.2,Graduate School of Science, Tohoku Univ.3) *Msaomi Sanekata1, Hiroshi Nishida1, Yoshihiro Hirai1, Koichi Matsuda1, Yuki Nakagomi1, Nobuo Nishimiya1, Hiroaki Yamamoto2, Masahide Tona2, Keizo Tsukamoto2, Keijiro Ohshimo3, Fuminori Misaizu3 |
| 13:00-14:40 | 2P006 | Branching of coordination bonds cleavage in transition-metal nitrosyl complex excited by ultraviolet light (Graduate School of Science, Hiroshima Univ.) *Hiroyuki Nakata, Keigo Nagamori, Katsuyoshi Yamasaki, Hiroshi Kohguchi |
| 13:00-14:40 | 2P007 | Conformational analysis of γ-Hexanolactone by microwave spectroscopy (Graduate School of Science and Technology,Sophia Univ.1,Graduate School of Science and Technology,Sophia Univ.2,Graduate School of Science and Technology,Sophia Univ.3) *Takahiro Takimoto1, Yoshiyuki Kawashima2, Nobuhiko Kuze3 |
| 13:00-14:40 | 2P008 | Observation of laser-assisted electron scattering with sub-10 fs laser pulses (Graduate School of Science, The Univ. of Tokyo) *Kota Kumakura, Motoki Ishikawa, Reika Kanya, Kaoru Yamanouchi |
| 13:00-14:40 | 2P009 | Cooperative effect between the dihydrogen bond and hydrogen bond observed in the Si-H∙∙∙H-O type dihydrogen-bonded clusters (School of Science, Kitasato University1,Graduate School of Science, Kitasato University2,Faculty of Science, Shizuoka University3) *Yoshiki Kigure1, Masaaki Uchida2, Takutoshi Shimizu2, Yasutoshi Kasahara1, Yoshiteru Matsumoto3, Haruki Ishikawa1 |
| 13:00-14:40 | 2P010 | Rate constant of ScO with oxygen in gas phase (Faculty of Science, Japan women's Univ.1,Faculty of Science, Ochanomizu Univ.2) *Takashi Imajo1, Nami Yamakita1, Tsuneo Hirano2 |
| 13:00-14:40 | 2P011 | Intermolecular vibration dynamics in nitrogen dimer studied by using femtosecond time resolved imaging (School of Science, Tokyo Tech) *Genki Ishibashi, Kenta Mizuse, Yasuhiro Ohshima |
| 13:00-14:40 | 2P012 | Terahertz spectroscopy of NHD radical (Graduate School of Science, Toho University1,Graduate School of Science, Toyama University2) *Hiroyuki Ozeki1, Misaki Tanioka1, Kaori Kobayashi2 |
| 13:00-14:40 | 2P013 | Dynamics of N-CHO and N-CH3 bonds cleavage in the photodissociation of N,N-Dimethylformamide (Hiroshima University) *Kosuke Inoue, Yuuki Onitsuka, Katsuyoshi Yamasaki, Hiroshi Kohguchi |
| 13:00-14:40 | 2P014 | Isotope effects on ultra-low-energy total electron scattering cross sections of hydrogen molecules (Dept. Chem. Tokyo Tech.1,Dept. Materials and Life Sci. Sophia Univ.2) *Takuma Okumura1, Tomokazu Ejiri1, Hirofumi Akasaka1, Kouichi Hosaka1, Masashi Kitajima1, Takeshi Odagiri2, Masamitsu Hoshino2 |
| 13:00-14:40 | 2P015 | Photodissociation dynamics of oriented halothane using hexapole electric field (Osaka Univ.1,Taiwan Univ.2) *Dock-chil Che1, Masaaki Nakamura2, Toshio Kasai2, King-chuen Lin2 |
| 13:00-14:40 | 2P016 | Tracing ejection and propagation of ion packets in the MALDI process probed by sheet-like nanosecond UV laser light (Faculty of Pharmaceutical Sciences, Niigata Univ. Pharmacy and Appl. Life Sciences) *Tatsuro Shirota, Saki Yokozawa, Chika Kawashima, Takahiro Moriyama, Kennosuke Hoshina |
| 13:00-14:40 | 2P017 | Electronic excited state of corannulene by supersonic jet spectrosocopy (Graduate School of Science, Kyoto Univ.1,Graduate School of Engineering, Osaka Univ.2) *Hiromi Tohyama1, Ayumi Kanaoka1, Masaaki Baba1, Hidehiro Sakurai2 |
| 13:00-14:40 | 2P018 | Investigation of isomerization pathways of azobenzene derivatives based on transition between photostationary states (Graduate School of Science, Kobe Univ.) *Hitomi Arai, Akihide Wada |
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| 13:00-14:40 | 2P019 | Near-infrared spectra of OH-stretching vibration second overtone region of Water-ethanol-glucose ternary system solution (NIT, Kumamoto College) *Junya Matsuda, Iori Sakata, Yoshisuke Futami |
| 13:00-14:40 | 2P020 | Correlation between flexible structure and phase behavior of ammonium-based ionic liquids (Graduate School of Science, Chiba Univ.) *Kenta Nishisato, Kozo Fujii, Takeshi Morita, Keiko Nishikawa |
| 13:00-14:40 | 2P021 | Electronic properties of azaphenanthrene compounds (Graduate School of Science and Technology, Kumamoto Univ.) *Rika Yamashita, Nobutsugu Hamamoto, Sachie Arae, Ryo Irie, Hitoshi Fujimoto |
| 13:00-14:40 | 2P022 | Dielectric peak and echo induced by a flow inversion in the nematic phase of 8CB (Fukuoka Univ., Fac. Sci.) *Masashi Koga, Keishi Negita |
| 13:00-14:40 | 2P023 | Color control of negative photochromic binaphthyl-bridged imidazole dimers (Department of Chemistry, School of Science and Engineering, Aoyama Gakuin Univ.) *Aya Kometani, Katsuya Mutoh, Jiro Abe |
| 13:00-14:40 | 2P024 | Correlation between Excited-state Structural Dynamics and Thermally Activated Delayed Fluorescence Properties of Carbazol-benzonitrile Derivatives (Department of Chemistry, Kyushu Univ.1,Department of Chemistry, Tokyo Institute of Technology2,OPERA, Kyushu University3,ERATO, Japan Science and Technology Agency4,Fukui Institute for Fundamental Chemistry, Kyoto University5) *Masaki Saigo1, Kiyoshi Miyata1, Sei-ichi Tanaka2, Tatsuhiko Mukuta2, Hajime Nakanotani3,4, Chihaya Adachi3,4, Tohru Sato5, Ken Onda1 |
| 13:00-14:40 | 2P025 | Cycloreversion Dynamics of a Diarylethene Derivative: Direct Observation of Formation of the Open-Ring Isomer Using Ultraviolet and Infrared Transient Absorption Spectroscopy (Graduate School of Engineering Science, Osaka Univ.1,Graduate School of Science and Engineering, Aoyama Gakuin Univ.2) *Hikaru Sotome1, Hajime Okajima2, Tatsuhiro Nagasaka1, Yuka Tachii1, Akira Sakamoto2, Hiroshi Miyasaka1 |
| 13:00-14:40 | 2P026 | Switching of energy transfer from organic ligand to central metal in lanthanoid complexes (Gakushuin University1,Banaras Hindu University2) *Daichi Enomoto1, Verma Abhineet2, Dwivedi Nidhi2, Tomohisa Takaya1, Sunkari Sailaja2, Saha Satyen2, Koichi Iwata1 |
| 13:00-14:40 | 2P027 | [Withdraw] |
| 13:00-14:40 | 2P028 | Viscosity of the lipid bilayer consisting of phospholipid and micellar detergent (Faculty of Science, Gakushuin Univ.) *Akira Takakado, Koichi Iwata |
| 13:00-14:40 | 2P029 | Synthesis of Chiral Labtb and Visualization of its Particular Chirality (Graduate School of Engineering, Kyushu Univ.1,Center for Molecular Systems, Kyushu Univ.2,Institute for Molecular Systems3) *Teppei Yamada1,2, Toshiki Eguchi1, Tetsuya Narushima3, Nobuo Kimizuka1,2 |
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| 13:00-14:40 | 2P030 | Crystal structure and photochromic behavior of salts containing cationic spiropyran (Fac, of Eng., Sanyo-onoda City Univ.1,Grad. sch of Eng., Sanyo-onoda City Univ.2) *Morihiro Ason1, Jun-ichiro Takebayashi2, Yusuke Funasako2, Makoto Inokuchi2 |
| 13:00-14:40 | 2P031 | Magnetic properties of conductive two-dimensional MOFs (Grad. Sch. of Sci., Nagoya Univ.1,RCMS, Nagoya Univ.2,Univ. of Hyogo3) *Yuki Misumi1, Zhongyue Zhang2, Kunio Awaga1, Akira Yamaguchi3, Taku Matsushita1, Nobuo Wada1 |
| 13:00-14:40 | 2P032 | Proton conduction of imidazole mixed with organic acid using molecular dynamics simulation (Graduate School of Natural Science and Technology, Kanazawa Univ.1,Institute for Frontier Science Initiative, Kanazawa Univ.2) *Toshiya Suetake1, Hiroki Sugisawa1, Tomonori Ida1, Motohiro Mizuno1,2 |
| 13:00-14:40 | 2P033 | Preparation and Properties on Conducting Thin-Film with Organic Acceptor TANC Formed on Cu or Ag Substrates (Department of Chemistry, Faculty of Science, Tokyo University of Science) *Daisuke Shirota, Hajime Kamebuchi, Makoto Tadokoro |
| 13:00-14:40 | 2P034 | Fluorescent chromism and mechanism of benzothiazole derivatives with pyridyl group (Graduate School of Engineering, Tohoku Univ.1,IMRAM, Tohoku Univ.2,Chitose Institute of Science and Technology3) *Keigo Takahashi1, Yuta Nakane1, Takashi Takeda1,2, Norihisa Hoshino1,2, Ken-ichi Sakai3, Tomoyuki Akutagawa1,2 |
| 13:00-14:40 | 2P035 | Evaluation of spatial coherence in one-dimensional organic semiconductor crystals (Graduate School of Materials Science, Nara Institute of Science and Technology) *Keisuke Nishiwaki, Hiroyuki Katsuki, Hisao Yanagi |
| 13:00-14:40 | 2P036 | Study of local distortions of the point defects by measuring the Q1 (0) transition of p-H2in CH3F/p-H2 crystal using infrared lasers pump-probe spectroscopy (Tokyo institute of technology) *Akira Nakaigawa, Hideto Kanamori |
| 13:00-14:40 | 2P037 | Hydrogen-bond structure and motility of water molecules accommodated in metal-organic framework CPL-1 as studied by vibrational spectroscopies (Kwansei Gakuin Univ.) *Takayuki Hiraoka, Shinsuke Shigeto |
| 13:00-14:40 | 2P038 | - |
| 13:00-14:40 | 2P039 | Preparation and polarity changes of photo-responsive ammonium-based ionic liquids containing spiropyran (Dept. of Appl. Chem., Fac. of Eng., Sanyo-onoda City University) *Yusuke Funasako, Naoto Horihata, Nozomi Azuma, Makoto Inokuchi |
| 13:00-14:40 | 2P040 | Anion exchange and proton conductivity of three dimensional coordination polymers having Cu3(μ3-O) (μ3-trz)3 framework (Graduate School of Chemical Science and Engineering, Hokkaido Univ.1,Department of Chemistry, Faculty of Science, Hokkaido Univ.2) *Akinobu Yasoshima1, Goro Maruta2, Yoshiyuki Kageyama2, Sadamu Takeda2 |
| 13:00-14:40 | 2P041 | Fabrication and characterization of organic field-effect transistors using BDH-TTP and its analogs (Graduate School of Material Science, Univ. of Hyogo1,College of Science, Ibaraki Univ.2) *Hiroshi Nishimoto1, Shota Inoi1, Tomofumi Kadoya1, Kazuya Kubo1, Hiroyuki Tajima1, Hiroyuki Nishikawa2, Jun-ichi Yamada1 |
| 13:00-14:40 | 2P042 | Improvement of conversion rate and efficiency for nuclear spin isomers of hydrogen molecule by porous coordination polymers (Graduate School of Science, Kyushu Univ.1,Graduate School of Engineering, Nagoya Univ.2) *Yuta Ohtsubo1, Akio Mishima2, Akihiro Hori2, Masaaki Ohba1 |
| 13:00-14:40 | 2P043 | Development of D-A type functional materials containing quinoid structure (Graduate School of Science, Osaka Prefecture Univ.) *Shino Fukui, Yuki Matsumoto, Hideki Fujiwara |
| 13:00-14:40 | 2P044 | Structural and physical properties of transition metal complexes based on pyridine ligand with DT-TTF (Graduate School of Science and Engineering, Ehime University1,Research Unit for Power Generation and Storage Materials, and Research Unit for Development of Organic Superconductors, Ehime University2,The Institute for Solid State Physics, The University of Tokyo3) *Takashi Shirahata1,2, Yusuke Shiroshita1, Thi thuy dung Hoa1, Naoya Kinoshita1, Aya Yoshimura1, Akira Ueda3, Hatsumi Mori3, Yohji Misaki1,2 |
| 13:00-14:40 | 2P045 | Conductive Polymer Modified Covalent Organic Framework (Integrated Research Consortium on Chemical Sciences (IRCCS), Nagoya University1,Department of Chemistry, Nagoya University2) *Yang Wu1, Dongwan Yan2, Zhongyue Zhang1,2, Michio m. Matsushita2, Kunio Awaga1,2 |
| 13:00-14:40 | 2P046 | Vibrational circular dichroism spectroscopy of pellet samples and its application to vacuum and cryogenic condition (Graduate School of Science and Engineering, Aoyama Gakuin Univ.) *Atsuya Nakajima, Hajime Okajima, Akira Sakamoto |
| 13:00-14:40 | 2P047 | Ferroelectricity of alkylamide substituted helicene derivatives through 2D hydrogen-bonding network (Grad. Sch. of Eng., Tohoku Univ.1,IMRAM, Tohoku Univ.2,Grad. Sch. of Pharm. Sci., Tohoku Univ.3) *Hayato Anetai1, Takashi Takeda1,2, Norihisa Hoshino1,2, Higashi Kobayashi3, Nozomi Saito3, Masanori Shigeno3, Masahiko Yamaguchi3, Tomoyuki Akutagawa1,2 |
| 13:00-14:40 | 2P048 | Low temperature selective catalytic reduction of NO with NH3 on vanadium oxide (Research Center for Gold Chemistry, Graduate School of Urban Environmental Sciences, Tokyo Metropolitan University1,Sanyo-onoda City University2,The Chugoku Electric Power Co., Inc.3) *Shinichi Hata1,2, Yusuke Inomata1, Makoto Mino1, Eiji Kiyonaga3, Keiichiro Morita3, Kazuhiro Yoshida3, Masatake Haruta1, Toru Murayama1 |
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| 13:00-14:40 | 2P049 | Oxygen adsorption and desorption of ultrathin Hafnium film on clean Si(100)-2×1 surface (Faculty of Science, Ehime University1,Japan Atomic Energy Agency2,Synchrotron Radiation Research Center, Nagoya University3) *Takuhiro Kakiuchi1, Hideki Yamasaki1, Chie Tsukada2,3, Akitaka Yoshigoe2 |
| 13:00-14:40 | 2P050 | HD-chiral VSFG spectroscopy of model polypeptides with known secondary structures at interface (Graduate School of Pure and Applied Sciences, University of Tsukuba) *Makoto Itagaki, Masanari Okuno, Taka-aki Ishibashi |
| 13:00-14:40 | 2P051 | Advantage of Semi-ionic Bonding in Fluorine-doped Carbon Materials for the Oxygen Evolution Reaction (Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1,Faculty of Science, Hokkaido Univ.2,Institute for International Collaboration, Hokkaido Univ.3) *Jeheon Kim1, Ruifeng Zhou3, Satoshi Yasuda2, Tomohiro Fukushima2, Kei Murakoshi2 |
| 13:00-14:40 | 2P052 | Photo dissociation reaction on water single molecular junction with copper electrodes (Dept. of Chem, Tokyo Tech.) *Risa Fukuzumi, Satoshi Kaneko, Manabu Kiguchi |
| 13:00-14:40 | 2P053 | Site dependence of local structure at ionic liquid / organic semiconductor interfaces by frequency modulation AFM (Graduate School of Engineering Science, Osaka Univ.1,Graduate School of Science, Kobe Univ.2,Graduate School of Frontier Sciences, Univ. Tokyo3) *Hiroaki Nato1, Taiki Sato1, Ichiro Tanabe1, Akira Sasahara2, Hiroshi Onishi2, Jun Takeya3, Ken-ichi Fukui1 |
| 13:00-14:40 | 2P054 | Determination of injection barrier at metal/organic interface using accumulated charge measurement (Graduate School of Material Science, University of Hyogo.1,Graduate School of Engineering, University of Hyogo.2) *Yuta Miyamoto1, Toshiaki Tanimura1, Masato Otsuka1, Tomofumi Kadoya1, Jun-ichi Yamada1, Tokuji Yokomatsu2, Kazusuke Maenaka2, Takeshi Komino1, Hiroyuki Tajima1 |
| 13:00-14:40 | 2P055 | Theoretical study of base-catalyzed reactions at water-oil interface (Graduate School of Science,TOHOKU Univ1,ESCIB, Kyoto University2) *Ai Koizumi1, Hirofumi Tahara1, Tomonori Hirano1, Lingjian Wang1, Akihiro Morita1,2 |
| 13:00-14:40 | 2P056 | Study on the self-assembled hetero-bilayers for control of electron-proton correlated properties (Graduate School of Science, Osaka Univ.1,ISSP, Univ. of Tokyo2,Graduate School of Information Sciences, Hiroshima City Univ.3,Graduate School of Nanobioscience, Yokohama City Univ.4) *Hiroyuki Kato1, Akira Ueda2, Susumu Yamamoto2, Yusuke Kanematsu3, Masanori Tachikawa4, Hatsumi Mori2, Jun Yoshinobu2, Iwao Matsuda2 |
| 13:00-14:40 | 2P057 | Elucidating water structure at the hydrophobic/water interface by heterodyne detected vibrational sum frequency generation (HD-VSFG) spectroscopy (Molecular Spectroscopy Laboratory, RIKEN, Japan1,RIKEN Center for Advanced Photonics (RAP), RIKEN, Japan2) *Sanat Ghosh1, Satoshi Nihonyanagi1,2, Tahei Tahara1,2 |
[Clusters/particles/nanostructures]
| 13:00-14:40 | 2P058 | Theoretical study of the containment of greenhouse gases in nanocarbon cube (Graduate School of Science, Tokai Univ.) *Erika Suwa, Shigeru Ishikawa |
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| 13:00-14:40 | 2P059 | Theoretical study of heterojunction effect in Au-Ni bimetal nanoparticle catalyst (Graduate School of Science, Osaka Univ.1,Graduate School of Urban Environmental Sciences, Tokyo Metropolitan Univ.2,Graduate School of Science, Kyushu Univ.3) *Yoshinori Ato1, Akihide Hayashi1, Takashi Kawakami1, Shusuke Yamanaka1, Tamao Ishida2, Makoto Tokunaga3, Mitsutaka Okumura1 |
| 13:00-14:40 | 2P060 | Degradation mechanism of methyl orange by using Au/TiO2 photocatalytic nanoparticles under neutral and acidic conditions (School of Humanity-oriented Science and Technology, Kinki Univ.1,Education and Research Center of Green Technology, Kyushu Univ.2,Global Innovation Center, Kyushu Univ.3,Interdisciplinary FactoryofScience and Engineering, Shimane Univ.4) *Yuna Arimura1, Kanako Matsuda1, Mayu Tanaka1, Hirofumi Kawazumi1, Keiko Uto2, Masaharu Tsuji2, Jun-ichiro Hayashi2, Hiroki Ago3, Takeshi Tsuji4 |
| 13:00-14:40 | 2P061 | Establishment of size selective synthesis method of platinum cluster and development of platinum cluster loaded catalysts and evaluation of their oxygen reduction catalytic ability (Graduate School of Science, Tokyo Univ. of Science) *Nobuyuki Shimizu, Atsuya Harasawa, Wataru Kurashige, Yuichi Negishi |
| 13:00-14:40 | 2P062 | Structures of aluminum oxide cluster cations investigated by ion mobility mass spectrometry (Graduate School of Science, Tohoku Univ.1,Institute for Excellence in Higher Education, Tohoku Univ.2) *Daiki Hebiguchi1, Motoyoshi Nakano1,2, Fuminori Misaizu1 |
| 13:00-14:40 | 2P063 | Ion mobility measurement on Ir oxide cluster anions: transition of structural motif along with oxidation (Graduate School of Science, the Univ. of Tokyo1,Graduate School of Science, Tohoku Univ.2,ESICB, Kyoto Univ.3,Institute for Excellence in Higher Education, Tohoku Univ.4) *Ryohei Tomihara1, Toshiaki Nagata2, Jenna w. j. Wu2, Kiichirou Koyasu1,3, Motoyoshi Nakano2,4, Keijiro Ohshimo2, Fuminori Misaizu2, Tatsuya Tsukuda1,3 |
| 13:00-14:40 | 2P064 | Fission of Multiply Charged Mercury Cluster Ions (College of Science and Techlonogy, Nihon University) *Masato Nakamura |
| 13:00-14:40 | 2P065 | QM/MM ONIOM calculations of methane activation on coinage metal-exchanged ZSM-5 zeolite (Kyoto Institute of Technology) *Tomo Nagahisa, Takashi Yumura, Takashi Wakasugi |
| 13:00-14:40 | 2P066 | Intramolecular excimer formation of dibenzo-crown ether complexes with metal ions (Graduate School of Science, Hiroshima University) *Mayuko Kubo, Manabu Abe, Takayuki Ebata, Yoshiya Inokuchi |
| 13:00-14:40 | 2P067 | Precise synthesis and characterization of thiolate protected alloy cluster by high performance liquid chromatography (Graduate School of Science, Tokyo University of Science) *Sayaka Hashimoto, Seiichiro Watanabe, Yoshiki Niihori, Wataru Kurashige, Yuichi Negishi |
| 13:00-14:40 | 2P068 | Electron spin resonance study on excited states of Sr-doped NaTaO3 photocatalysts (Graduate School of Science, Kobe Univ.) *Takamasa Sato, Yasuhiro Kobori, Hiroshi Onishi |
| 13:00-14:40 | 2P069 | Construction of a small endcap trap and observation of fluorescence enhancement effect caused by excitation light resonance on a microdroplet (Graduate School of Science, Osaka city Univ.) *Motoya Sano, Tomoyuki Yatsuhashi, Kenji Sakota |
| 13:00-14:40 | 2P070 | Insertion of Co cluster ions with adsorbate molecules into He clusters – for the spectroscopic measurements of cluster catalysts (Genesis Res. Inst.1,Toyota Tech. Inst.2) *Hideho Odaka1, Masahiko Ichihashi2 |
| 13:00-14:40 | 2P071 | Rapid characterization of single catalyst particle by using tandem electrodynamic trap technique (Graduate School of Science, Gakushuin Univ.1,Faculty of Science, Gakushuin Univ.2) *Anna Shirono1, Shuto Ebara2, Takaaki Eguchi1, Hiroya Asami2, Jun-ya Kohno1,2 |
| 13:00-14:40 | 2P072 | Applied potential dependence of MoS2 nanosheet photocorrosion (Graduate School of Science, Kyoto Univ.1,Institute of Molecular Science2,JST PRESTO3,Toyota Institute of Physical and Chemical Research4) *Yuzu Kobayashi1, Kazuya Watanabe1, Toshiki Sugimoto2,3, Yoshiyasu Matsumoto4 |
| 13:00-14:40 | 2P073 | Infrared photodissociation spectroscopy of Ptn(H2O)m+ in the gas phase (School of Arts and Sciences, The University of Tokyo) *Manami Abe, Satoshi Kudoh, Ken Miyajima, Fumitaka Mafune |
| 13:00-14:40 | 2P074 | Chemical Stability of 3-5 Group Transition-Metal Atom Encapsulating Si16 Cage Nanocluster Superatoms Supported on Organic Molecular Substrates (Keio Univ.1,Keio KiPAS2) *Toshiaki Kamoshida1, Masahiro Shibuta2, Tsutomu Ohta1, Hironori Tsunoyama1, Atsushi Nakajima1,2 |
| 13:00-14:40 | 2P075 | The stability of supported metal sub-nano cluster (Lab. Chem. Life Sci., Tokyo Tech･JST-ERATO) *Takaaki Onishi, Takane Imaoka, Kimihisa Yamamoto |
| 13:00-14:40 | 2P076 | Color changes of Hydroxocobalamin based on radical reaction mechanism (Faculty of Pharmaceutical Science, Tokyo University of Science) *Kenshiro Kobayashi, Ayaka Takara, Yohsuke Shimada, Yuta Otsuka, Satoru Goto |
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| 13:00-14:40 | 2P077 | Oxybuprocaine Incentivizing the Enhancement of the Observed Solubility of Piroxicam Beyond its Peculiar Supersaturation (Graduate School of Pharmaceutical Sciences, Tokyo University of Science1,Teikoku Seiyaku Co.2) *Momoko Fujita1, Yohsuke Shimada1, Yuta Otsuka1, Satoru Goto1, Katsuyuki Inoo2 |
| 13:00-14:40 | 2P078 | Theoretical study on mechanism for controlling hemoglobin function by allosteric interaction with chloride ions (Graduate School of Informatics, Nagoya Univ.1,CREST, JST2,ESICB, Kyoto Univ.3) *Yume Takahashi1, Ikuo Kurisaki1,2, Masataka Nagaoka1,2,3 |
| 13:00-14:40 | 2P079 | Comparison study of affinities for a sialylated glycan among HIV-1 neutralizing antibodies (College of Liberal Arts and Sciences, Kitasato Univ.) *Kaori Ueno-noto |
| 13:00-14:40 | 2P080 | Observation structural change of the chromophore of the fluorescent protein rb-Akane with various spectroscopy (Graduate School of Science, Kitasato Univ.1,School of Science, Kitasato Univ.2) *Takahiro Miyanaga1, Yasutoshi Kasahara2, Haruki Ishikawa2 |
| 13:00-14:40 | 2P081 | Photoresponsive dynamics of the bacteriophytochrome DrBphP photoreception domain (Graduate School of Science,Kyoto Univ.) *Keiya Tachikawa, Kimitoshi Takeda, Yusuke Nakasone, Masahide Terazima |
| 13:00-14:40 | 2P082 | Efficient approach to search fragment-binding poses in the restricted sampling space (Fujitsu Lab. Ltd.) *Hiroyuki Sato, Yoshiaki Tanida, Azuma Matsuura |
| 13:00-14:40 | 2P083 | Prediction of binding affinity of XAV939/Tankyrase-2 using alchemical free energy calculation (Fujitsu Laboratories Ltd.) *Yoshiaki Tanida, Azuma Matsuura |
| 13:00-14:40 | 2P084 | Flexible fitting of biomolecular structures to high-speed atomic force microscopy image data: Application to nucleosome with linker DNAs (Grad. Sch. of Science, Kyoto Univ.1,CREST, JST2) Toru Niina1, *Sotaro Fuchigami1,2, Shoji Takada1,2 |
| 13:00-14:40 | 2P085 | Factors influencing oligomeric stability of light-driven sodium ion pump (Graduate School of Science, Osaka Univ.1,The Institute for Solid State Physics, The University of Tokyo2,Department of Life Science and Applied Chemistry, Nagoya Inst. Tech.3) *Akihiro Otomo1, Misao Mizuno1, Rei Abe-yoshizumi3, Keiichi Inoue2, Hideki Kandori3 |
| 13:00-14:40 | 2P086 | Effects of nitrogen atom on electronic properties of phenanthrene (Graduate school of science and Technology, Kumamoto University) *Nobutsugu Hamamoto, Hitoshi Fujimoto |
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| 13:00-14:40 | 2P087 | Theoretical study of collective rotational motion of ionic aqueous solution (Department of Functional Molecular Science, SOKENDAI1,Institute for Molecular Science2,Graduate School of Science, Kobe Univ.3,Molecular Photoscience Research Center, Kobe Univ.4) *Norifumi Moritsugu1, Takafumi Nara3, Shin-ichi Koda1,2, Keisuke Tominaga3,4, Shinji Saito1,2 |
| 13:00-14:40 | 2P088 | Theoretical studies on oxidative kinetic resolution of racemic secondary alcohols using chiral ligand-hybridized nitroxyl radical/copper cooperative catalysis (Grad. Sch. Sci. Eng., Ibaraki Univ.1,Grad. Sch. Pharm. Sci., Tohoku Univ.2) *Kyohei Kawashima1, Yusuke Sasano2, Koki Kasabata2, Naoki Kogure2, Yoshiharu Iwabuchi2, Seiji Mori1 |
| 13:00-14:40 | 2P089 | Analysis of protonation state of critic acid by molecular dynamics (Graduate School of Science, Tsukuba Univ.) *Yoshihiro Tanaka, Toru Matsui, Kenji Morihashi |
| 13:00-14:40 | 2P090 | Theoretical study on singlet fission for sumanene-fused acene (Graduate School of Engineering Science, Osaka University1,Institute for molecular science (IMS)2) *Kenichiro Watanabe1, Takanori Nagami1, Takayoshi Tonami1, Kenji Okada1, Soichi Ito2, Masayoshi Nakano1,2 |
| 13:00-14:40 | 2P091 | Prediction of physical properties of molecules with neural networks (HPC Systems Inc.) *Seiji Ueno |
| 13:00-14:40 | 2P092 | Theoretical analysis of the dipole moment function and its nuclear coordinate derivatives for OH stretching vibration of ROH type molecules (Graduate School of Science and Technology, Keio Univ.) *Yuto Kugaya, Masafumi Tsuyuki, Satoshi Yabushita |
| 13:00-14:40 | 2P093 | Multicanonical MC studies on second-order phase transition between water and ice VII (Dept. of Int. Liberal Studies, Chukyo Univ.) *Chizuru Muguruma |
| 13:00-14:40 | 2P094 | Estimation of QM / MM calculation error based on linear response function and approaches to boundary setting (Graduate School of Science, Osaka Univ.1,National Institute of Genetics2) *Jinta Ohnari1, Tomohiro Maruyama1, Yuki Mitsuta1, Shusuke Yamanaka1, Takashi Kawakami1, Haruki Nakamura2, Mitsutaka Okumura1 |
| 13:00-14:40 | 2P095 | Electron and molecular dynamics induced by a near-field excitation (Graduate school of science, Hokkaido Univ.1,Graduate school of chemical sciences and engneering, Hokkaido Univ.2,ESICB, Kyoto Univ.3) *Takeshi Iwasa1,2,3, Masato Takenaka2, Tetsuya Taketsugu1,2,3 |
| 13:00-14:40 | 2P096 | Vibrational analysis of perfluorinated imide sulfonic acid ionomer side chain model compounds (FC-Cubic) *Makoto Yamaguchi |
| 13:00-14:40 | 2P097 | Assessment of solvation free energy expressions incorporating the orientation of solvent molecules in the 3D-RISM theory (Department of Chemistry, Graduate School of Science, Kyushu University, Japan) *Shoichi Tanimoto, Norio Yoshida, Haruyuki Nakano |
| 13:00-14:40 | 2P098 | Theoretical study of NO reduction on Rh cluster (ESICB, Kyoto Univ.1,Department of Chemistry, Faculty of Science, Hokkaido Univ.2,Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.3) *Yusuke Kondo1, Takeshi Iwasa1,2,3, Tetsuya Taketsugu1,2,3 |
| 13:00-14:40 | 2P099 | Theoretical analysis on mechanism of electron transfer at oil/water interfaces by multidimensional free energy calculations (Graduate School of Science, Tohoku Univ.1,ESICB, Kyoto Univ.2) *Tomonori Hirano1, Lingjian Wang1, Hirofumi Tahara1, Ai Koizumi1, Akihiro Morita1,2 |
| 13:00-14:40 | 2P100 | Elementary reaction path search of hydrogen and hydrocarbon combustion by quantum chemical calculation (Hokkaido Univ.1,Hokkaido Univ.2) *Yoshiaki Tsunekawa1, Satoshi Maeda2 |
| 13:00-14:40 | 2P101 | Controlled intersystem crossing in iron porphycene substituted myoglobin for cyclopropanation reaction: a theoretical study (Graduate School of Chemical Sciences and Engineering, Hokkaido University1,Institute for Catalysis, Hokkaido University2,Department of Applied Chemistry, Graduate School of Engineering, Osaka University3) *Liming Zhao1, Akira Nakayama2, Koji Oohora3, Hiroyuki Meichin3, Takashi Hayashi3, Jun-ya Hasegawa2 |
| 13:00-14:40 | 2P102 | Characterization of polymer properties based on model-based reasearch (Graduate School of Nanobioscience, Yokohama City University1,Graduate School of Engineering, Hiroshima University2) *Takayoshi Ishimoto1, Satoru Tsukada2, Joji Ohshita2, Hiroyuki Kai2 |
| 13:00-14:40 | 2P103 | Relation between spin vorticity and electric current in planar structure materials (Graduate School of Engineering, Kyoto University) *Naoyuki Nosohara, Masato Senami |
| 13:00-14:40 | 2P104 | Microscopic Structure of Hydrate-Melt Electrolyte for Aqueous Li-Ion Batteries on Electrode Surface (ESICB, Kyoto Univ.1,Graduate School of Informatics2,CREST-JST3) *Norio Takenaka1,2, Taichi Inagaki2, Masataka Nagaoka1,2,3 |
| 13:00-14:40 | 2P105 | Improving the elongation method: intermediate electrostatic field for DNA and proteins via genetic algorithms (Dept Mol & Mat Sci, Kyushu Univ.1,Dept Chem, Jagiellonian Univ.2) *Denis Mashkovtsev1, Wataru Mizukami1, Jacek Korchowiec1,2, Anna Stachowicz-kuśnierz2, Yuriko Aoki1 |
| 13:00-14:40 | 2P106 | A density-functional tight-binding study of charge carrier properties in perovskite photovoltaics (Graduate School of Advanced Science and Engineering, Waseda Univ.1,Waseda Research Institute for Science and Engineering2,ESICB, Kyoto Univ.3) *Hiroki Uratani1, Chien-pin Chou2, Hiromi Nakai1,2,3 |
| 13:00-14:40 | 2P107 | Theoretical calculations of photoionization cross-sections with complex basis function method including relativistic effects (Graduate School of Science and Technology, Keio Univ.) *Naoto Furuhashi, Satoshi Yabushita |
| 13:00-14:40 | 2P108 | The reaction path optimization of the deacylation process in acyl-enzyme complex of class C β-lactamase and cefalotin (Department of Chemistry, Osaka Pref. Univ.1,The Research Institute for Molecular Electronic Devices (RIMED), Osaka Pref. Univ.2) *Nozomi Sawada1, Toshio Asada1,2, Shiro Koseki1,2 |
| 13:00-14:40 | 2P109 | Non-adiabatic ab initio molecular dynamics on ultra-violet photodissociation of methylamine (The Graduate School of Science and Technology, Sophia Univ.) *Yurika Takaku, Shinkoh Nanbu |
| 13:00-14:40 | 2P110 | Size dependence of water cluster on the interaction between the cluster and CO molecules (Yokohama National University) *Kazuaki Kuwahata, Kaoru Ohno |
| 13:00-14:40 | 2P111 | Molecular dynamics simulations of hydrocarbon-based proton exchange membrane (Graduate School of Engineering, Univ of Fukui.1,Institude of Fluid Science, Tohoku Univ.2,Faculty of Engineering , Univ of Fukui.3) *Keitaro Kouda1, Takashi Tokumasu2, Akinori Fukushima3 |
| 13:00-14:40 | 2P112 | Regioselective borylation of sp3 C-H bond of N-hetrocycles catalyzed by cooperative system consisting of iridium(III) boryl complex and Lewis acid (FIFC, Kyoto Univ.1,Graduate School of Engineering, Kyoto Univ.2) *Rong-lin Zhong1, Yoshiaki Nakao2, Shigeyoshi Sakaki1 |
| 13:00-14:40 | 2P113 | Theoretical analysis of Au electrode potential shift by ionic liquid (Graduate School of Informatics, Nagoya Univ.1,ESICB, Kyoto Univ.2,CREST-JST3) *Taichi Inagaki1, Norio Takenaka1,2, Masataka Nagaoka1,2,3 |
| 13:00-14:40 | 2P114 | Materials informatics for designing organic Luminescent materials with high color-purity (Department of Chemistry & Biochemistry, Ochanomizu univ.1,Faculty of Core Research, Natural Science Division, Ochanomizu Univ.2,JST PRESTO3) *Chieko Terashima1, Hirotoshi Mori2,3 |
| 13:00-14:40 | 2P115 | Theoretical study of dissociative adsorption and dimerization of NO on Agn and Cun clusters (n = 2, 5, 7, 38) (ESICB, Kyoto Univ.1,FIFC, Kyoto Univ.2,IMS3) *Nozomi Takagi1, Masayuki Nakagaki2, Kazuya Ishimura3, Ryoichi Fukuda1, Masahiro Ehara1,3, Shigeyoshi Sakaki1,2 |
| 13:00-14:40 | 2P116 | Nonadiabatic molecular dynamics simulation toward understanding the mechanisms of photovoltaic solar cells (R-CCS, RIKEN) *Noriyuki Minezawa, Takahito Nakajima |
| 13:00-14:40 | 2P117 | Phase diagram of ice in the negative pressure area (Graduate School of Science, Okayama Univ.1,Okayama Univ Basic Laboratory2) *Takahiro Matsui1, Masanori Hirata1, Masakazu Matsumoto2, Hideki Tanaka2, Takuma Yagasaki2 |
| 13:00-14:40 | 2P118 | Low-scaling multi-configuration/multi-state SCF via single excitation operators (Graudate School of System Informatics, Kobe Univ.) *Takashi Tsuchimochi |
| 13:00-14:40 | 2P119 | Development of machine-learned kinetic potential functional for optimization of the electron density (School of Advanced Science and Engineering, Waseda Univ.1,Research Institute for Science and Engineering, Waseda Univ.2,JST-PRESTO3,ESICB, Kyoto Univ.4) *Ryo Kageyama1, Junji Seino2,3, Mikito Fujinami1, Yasuhiro Ikabata2, Hiromi Nakai1,2,4 |
| 13:00-14:40 | 2P120 | Study on the potential energy curve of the CH molecule by the Free Complement method (QCRI) *Yusaku Kurokawa, Hiroyuki Nakashima, Hiroshi Nakatsuji |
| 13:00-14:40 | 2P121 | Study of the Metal-Metal Bonds by the Free Complement - Chemistry Formula Theory (Quantum Chemistry Research Institute) *Hiroyuki Nakashima, Yusaku Kurokawa, Hiroshi Nakatsuji |
| 13:00-14:40 | 2P122 | σ-π interaction effects in the Raman intensity of low-frequency modes of [2.2]paracyclophane (Graduate School of Informatics and Engineering, the Univ. of Electro-Communications1,School of Informatics and Engineering, the Univ. of Electro-Communications2,Graduate School of Science, Tohoku Univ.3) Yoshihiro Yamakita1, *Keigo Yamaguchi2, Koichi Ohno3 |
| 13:00-14:40 | 2P123 | Theoretical study on enantioselective Michael addition catalyzed by chiral rare rarth metal / N,N’-dioxide complexes (Graduate School of Materials Science, NAIST1,Institute for Research Initiatives, NAIST2,JST PRESTO3) *Aya Miyazaki1, Miho Hatanaka1,2,3 |
| 13:00-14:40 | 2P124 | Computational methods of transition dipole moments within CI method: response-type vs Hellmann-Feynman type (Faculty of Science and Technology, Keio University) *Satoshi Yabushita, Tomohiro Inoue, Yasuomi Suzuki |
| 13:00-14:40 | 2P125 | Computational study on the stereoselective ring-opening alkylation catalyzed by chiral triazolium salt (Graduate School of Materials Science, NAIST1,Institute for Research Initiatives, NAIST2,JST PRESTO3) *Anna Kamada1, Miho Hatanaka1,2,3 |