Tuesday, September 13(Starting at 13:10)
The number before P in the Presentation Number indicates whether the poster presentation is given on the 1st, 2nd, 3rd day of the meeting.
Venue P
[Gas phase]
| 13:10-14:50 | 1P001 | UV and UV-UV hole-burning spectra of benzo-12-crown-4 ion complexes under cold gas-phase conditions (Faculty of Science, Hiroshima Univ.1,Graduate School of Science, Hiroshima Univ.2)*Maki Nakatsuma1,Motoki Kida2,Takayuki Ebata2,Yoshiya Inokuchi2 |
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| 13:10-14:50 | 1P002 | An ab initio study to develop the four low-lying electronic potential energy curves between atomic cesium and rare gases (Graduate School of Engineering, Hiroshima Univ.)*Takanori Kobayashi,Leo Matsuoka,Kenta Yuki,Shinichi Namba |
| 13:10-14:50 | 1P003 | Theoretical study on the size dependence of ground state proton transfer in 1-naphthol ammonia clusters (Laboratory for Chemistry and Life Science, Tokyo Institute of Technology)*Toshihiko Shimizu,Mitsuhiko Miyazaki,Masaaki Fujii |
| 13:10-14:50 | 1P004 | Electronic structure of Alq3 anion studied by photoelectron spectroscopy and density functional theory calculation (Grad. Sch. Sci., The Univ. of Tokyo1,Grad. Sch. Arts and Sci., The Univ. of Tokyo2,ESICB, Kyoto Univ.3)*Toshiaki Yanase1,Satoru Muramatsu1,Ryuzo Nakanishi2,Kiichirou Koyasu1,3,Takashi Nagata2,Tatsuya Tsukuda1,3 |
| 13:10-14:50 | 1P005 | Infrared spectroscopy of protonated and ionic hydrogen sulfide clusters H+(H2S)n and (H2S)n+ (n≤6) (Graduate School of Science, Tohoku University)*Dandan Wang,Asuka Fujii |
| 13:10-14:50 | 1P006 | Infrared spectroscopic observation of structure change of the methyl group in methyl iodide along with C-I bond extension (Graduate School of Science, Tohoku Univ.)*Takashi Chiba,Asuka Fujii |
| 13:10-14:50 | 1P007 | Determination of solvation structure of 3-aminopyridine-(water-methanol) mixed clusters by vibrational spectroscopy (Fukuoka Univ.)*Mao Ogawa,Yoichi Ishida,Yuji Yamada,Yoshinori Nibu |
| 13:10-14:50 | 1P008 | Multi-step intersystem crossing and subsequent photoisomerizations of protonated phenylalanine serine dimers (Graduate School of Science, Hokkaido Univ.1,JST-CREST2)*Kaoru Yamazaki1,2,Yu Harabuchi1,2,Satoshi Maeda1,2,Tetsuya Taketsugu1,2 |
| 13:10-14:50 | 1P009 | Ultrafast nuclear dynamics in methylamine in few-cycle laser field (School of Science,Univ. of Tokyo)*Meng Zhang,Toshiaki Ando,Atsushi Iwasaki,Kaoru Yamanouchi |
| 13:10-14:50 | 1P010 | Classical trajectories of hydrogen atom scrambling in ethane dication (School of Science, The University of Tokyo)*Katsunori Nakai,Kaoru Yamanouchi |
| 13:10-14:50 | 1P011 | Reaction pathway analysis of hydrogen migration in methanimine (School of Science, The University of Tokyo)*Sho Koh,Katsunori Nakai,Kaoru Yamanouchi |
| 13:10-14:50 | 1P012 | Asymmetric bond scission of CO2 by two-color phase-locked intense laser pulses (Graduate School of Science, Nagoya Univ.1,RCMS, Nagoya Univ.2,INRS-EMT3)*Hikaru Fujise1,Tomoyuki Endo2,3,Yuuna Kawachi1,Ayaka Ishihara1,Akiyoshi Hishikawa1,2 |
| 13:10-14:50 | 1P013 | Lithium ion transfer and competitive reactions in the gas phase (Faculty of Arts and Science, Kyushu Univ.1,Dept. of Molecular and Material Sciences, Kyushu Univ.2)*Kenji Furuya1,2 |
| 13:10-14:50 | 1P014 | Theoretical research of the photodissociation process of nitric acid using ab initio molecular dynamics approach (Sophia Univ.)*Sodai Takashima,Yuya Saga,Shinkoh Nanbu |
| 13:10-14:50 | 1P015 | Angular correlation of the Lyman-α photon pair in the photodissociation of H2, HD, and D2 (Tokyo Institute of Technology1,University of Kassel2,Sophia University3,University of Oulu4)*Yutaro Torizuka1,Kouichi Hosaka1,Philipp Schmidt2,Kazufumi Yachi1,Takeshi Odagiri3,Andre Knie2,Kari Jankala4,Arno Ehresmann2,Masashi Kitajima1,Noriyuki Kouchi1 |
| 13:10-14:50 | 1P016 | Kinetics of the reaction of ScO radicals with O2, C3H6, C2H4 (Faculty of Science, Japan Women's Univ.)*Nami Yamakita,Mariho Kitajima,Takashi Imajo |
| 13:10-14:50 | 1P017 | [Withdraw] |
| 13:10-14:50 | 1P018 | Microwave Spectra of X2Y-NCS and X2Y-NCO（X = F,Cl、Y = PS,PO） (Graduate School of Science and technology, Sophia Univ.)*Yuki Tajimi,Nobuhiko Kuze |
| 13:10-14:50 | 1P019 | Effect of the large amplitude motions on anharmonic vibrational corrections (Graduate School of Science and Technology, Sophia Univ.)*Nobuhiko Kuze,Anna Yorimitsu,Takuya Ishizuka |
| 13:10-14:50 | 1P020 | High-resolution Laser spectroscopy of NO2 radical in the region of 615-670 nm (Kobe Univ.1,Kobe Univ.2)*Shunji Kasahara1,Kohei Tada1,Michihiro Hirata2 |
| 13:10-14:50 | 1P021 | Foreign gas effect on A-band absorption spectrum of Molecular Oxygen (Tokyo Tech)*Atsushi Shoji,Wataru Kashihara,Takehiro Hidemori,Kazuhiko Shibuya,Akio Kawai |
| 13:10-14:50 | 1P022 | A search for the HOCO radical in the massive star-forming region Sgr B2(M) (Tokyo University of science1,Sophia University2,Gunma University3,National Chiao Tung University4,Nihon University5)*Rin Abe1,Ayane Miyazaki1,Takahiro Oyama1,Mitsunori Araki1,Shuro Takano5,Nobuhiko Kuze2,Yoshihiro Sumiyoshi3,Koichi Tsukiyama1,Yasuki Endo4 |
[Liquid phase]
| 13:10-14:50 | 1P023 | The density fluctuation of supercritical ammonia and the effect of hydrogen bonding (Graduate School of Advanced Integration Science, Chiba Univ.)*Sayuri Goto,Satoshi Shibuta,Takeshi Morita,Keiko Nishikawa |
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| 13:10-14:50 | 1P024 | Spectroscopic thermometry of a liquid droplet evaporatively cooled in a vacuum (Department of Chemistry, Kyushu University)*Kota Ando,Masashi Arakawa,Akira Terasaki |
| 13:10-14:50 | 1P025 | Dynamics of Hydration Water Around Tetraphenyl Borate by Broadband Spectroscopy (Graduate Schoool of Science, Kobe Univ.1,Molecular Photoscience Research Center, Kobe Univ.2)*Takafumi Nara1,Kaoru Ohta2,Keisuke Tominaga1,2 |
| 13:10-14:50 | 1P026 | Broadband dielectric spectroscopic measurements and theoretical calculations on H2O, D2O, and H218O (Graduate School of Science, Kobe Univ.1,Molecular Photoscience Research Center, Kobe Univ.2,Institute for Molecular Science.3)*Mariko Nakatsuka1,Masaki Okuda1,Naoki Yamamoto1,Kaoru Ohta2,Shinji Saito3,Keisuke Tominaga2 |
| 13:10-14:50 | 1P027 | Structure stability of protein in water/DMSO binary mixtures studied by broadband dielectric and vibrational spectroscopy (Graduate School of Science, Kobe Univ.1,Molecular Photoscience Research Center, Kobe Univ.2)*Miki Iinuma1,Naoki Yamamoto1,Kaoru Ohta2,Eri Chatani1,Keisuke Tominaga1,2 |
| 13:10-14:50 | 1P028 | The effect of ionic liquid on the stability of protein (Faculty of Science, Fukuoka Univ.1,National Defense Academy2)*Koji Yoshida1,Ayako Fujiyoshi1,Toshio Yamaguchi1,Takahiro Takekiyo2,Yukihiro Yoshimura2 |
| 13:10-14:50 | 1P029 | The synergistic effect of Hofmeister anions and polyethylene glycol on the structural transition of hydroxypropyl cellulose (Graduate School of Science, Kyushu Univ.1,Graduate School of Science, Osaka City Univ.2)*Karin Yoneyama1,Hiroshi Sekiya1,Kenji Sakota2 |
| 13:10-14:50 | 1P030 | Variation of near-infrared absorption spectrum of water by hydroxyl ion and hydronium ion (Graduate School of Agr. , TUAT1,United graduate School of Agr. Sci. , TUAT2)*Sayaka Katsu1,Masao Takayanagi2,Norio Yoshimura2 |
| 13:10-14:50 | 1P031 | solvent dependence of N 1s soft X-ray emission spectra for trimethylamine-N-oxide solution (Graduate School of Science, Hiroshima Univ.1,RIKEN SPring-8 center2,Graduate School of Sciences and Technology for Innovation, Yamaguchi Univ.3,Hiroshima Univ., QuLiS4)*Yuu Sasaki1,2,Yuka Horikawa3,2,Takashi Tokushima2,Kazumasa Okada1,2,Masaki Oura2,Misako Aida1,4 |
| 13:10-14:50 | 1P032 | Local structure observation of aqueous KSCN solution by soft X-ray absorption spectroscopy (IMS)*Hayato Yuzawa,Masanari Nagasaka,Nobuhiro Kosugi |
| 13:10-14:50 | 1P033 | Behavior and hydrating structure of saccharide confined to molecule-based nanoporous framework (TUS1,Tohoku Univ.2)*Nao Tamaki1,Asuka Takeuchi1,Hajime Kamebuchi1,Hiroshi Matsui2,Makoto Tadokoro1 |
| 13:10-14:50 | 1P034 | Behavior of Water Molecular Cluster Dissolving Eletrolyte Confined to Molecule-based Nanoporous Crystal (TUS)*Chiaki Dohi,Yurie Sugio,You Suzuki,Hajime Kamebuchi,Makoto Tadokoro |
| 13:10-14:50 | 1P035 | Gas hydrate stabilized in molecule-based nanoporous framework (TUS)*Yoshiaki Yamagishi,Rentaro Nakayama,You Suzuki,Hajime Kamebuchi,Makoto Tadokoro |
| 13:10-14:50 | 1P036 | Infrared electroabsorption spectroscopy of water in nanoconfinement (Graduate School of Science and Technology, Kwansei Gakuin Univ.)*Shogo Toda,Shinsuke Shigeto |
| 13:10-14:50 | 1P037 | Study on strong coupling system of J-aggregates in liquid phases (Graduate School of Material Science,NAIST)*Genta Tatsumi,Hiroyuki Katsuki,Hisao Yanagi |
[Solid phase]
| 13:10-14:40 | 1P038 | Modulation of the electronic and electrochemical properties of metal organic-frameworks with guest introduction (Graduate School of Science, Nagoya Univ.1,Research Center for Materials Science, Nagoya Univ.2)*Shouhei Yamamoto1,Zhongyue Zhang1,2,Kunio Awaga1,2 |
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| 13:10-14:40 | 1P039 | Structure and Charge-Discharge Properties of LiF-MO (M=Ni, Mn) composites (Graduate School of Integrated Science and Technology, Shizuoka University1,YAMAHA Motor CO., LTD2)*Yasumasa Tomita1,Yusuke Izumi1,Hiromasa Nasu1,Juichi Arai2,Kenkichiro Kobayashi1 |
| 13:10-14:40 | 1P040 | Rectified ionic conduction in ionic disordered crystals (Graduate School of Engineering, Kyushu Univ.1,the Center for Molecular Systems, Kyushu University2,PREST, JST3,Graduate School of Science, Kyoto University4,Japan Synchrotron Radiation Research Institute5)*Masaya Matsuki1,Teppei Yamada1,2,3,Shun Dekura4,Hiroshi Kitagawa4,Nobuhiro Yasuda5,Nobuo Kimizuka1,2 |
| 13:10-14:40 | 1P041 | The synthesis of porous complex and their proton conductivity (Graduate School of Chemical Science and Engineering, Hokkaido Univ1,Graduate School of Science, Hokkaido Univ2)*Kaoru Konno1,Goro Maruta2,Yosiyuki Kageyama2,Sadamu Takeda2 |
| 13:10-14:40 | 1P042 | Proton Conductivity in Imidazolium Diphosphonate Crystal (Material chemistry of Kanazawa Univ.)*Ryota Une,Hiroki Huwa,Ryutarou Ohashi,Tomonori Ida,Motohiro Mizuno |
| 13:10-14:40 | 1P043 | Electrochemical Control of Metal Oxide Superconduction (Graduate School of Science and Technology, Kwansei Gakuin Univ.1,Graduate School of Science, Nagoya Univ.2)*Takeshi Shimizu1,Kunio Awaga2,Hirohumi Yoshikawa1 |
| 13:10-14:40 | 1P044 | DFT study of vibronic coupling in organic thermoelectric materials (Graduate School of Materials Science, Nara Institute of Science and Technology)*Hirotaka Kojima,Ryo Abe,Fumiya Fujiwara,Mario Nakagawa,Masakazu Nakamura |
| 13:10-14:40 | 1P045 | Thermal conductivity measurement for θ-type organic conductor (Graduate School of Science, Osaka Univ)*Tetsuya Nomoto,Satoshi Yamashita,Hiroki Akutsu,Yasuhiro Nakazawa |
| 13:10-14:40 | 1P046 | Magnetic structure of β'-(bedt-ttf)(tcnq) at low temperature (Graduate School of Science, Osaka Univ.)*Keisuke Moriyasu,Shusaku Imajo,Satoshi Yamashita,Hiroki Akutsu,Yasuhiro Nakazawa |
| 13:10-14:40 | 1P047 | Non stripe charge order in organic conductors (Department of Materials Science and Engineering)*Takehiko Mori |
| 13:10-14:40 | 1P048 | Band filling dependence of thermopower in β'-(ET)3(CoCl4)2-x(GaCl4)x (Tokyo Institute of Technology1,The University of Tokyo2)*Yasuhiro Kiyota1,Tadashi Kawamoto1,Hatsumi Mori2,Takehiko Mori1 |
| 13:10-14:40 | 1P049 | Uniaxial pressure effects on β″-type ET salts (Grad. Sch. Sci., Eng., Ehime Univ.1,Grad. Sch. Sci., Osaka Univ.2)*Yuichi Okii1,Takashi Yamamoto1,Toshio Naito1,Kensuke Konishi1,Hiroki Akutsu2,Yasuhiro Nakazawa2 |
| 13:10-14:40 | 1P050 | Properties of the superconducting transition of k-(ET)2Cu[N(CN)2]I (Graduate School of Science and Engineering, Ehime Univ.)*Yusuke Nakamura,Takashi Yamamoto,Toshio Naito,Kensuke Konishi |
| 13:10-14:40 | 1P051 | Anomalous dielectric response in the organic conductor (BEDT-TTF)3(ReO4)2 (Graduate School of Engineering, Tokyo Polytech. Univ.1,Institute for Molecular Science2)*Kohei Karino1,Mikio Uruichi2,Toshihiro Hiejima1 |
| 13:10-14:40 | 1P052 | Control of molecular arrangement based on σ-hole bonds in metalladithiolene anion radical salts (Grad. Sch. Sci., The Univ. of Tokyo)*Chie Ohde,Tetsuro Kusamoto,Hiroshi Nishihara |
| 13:10-14:40 | 1P053 | Synthesis, structures, and properties of molecular conductors based on new ST-STP donors aiming at intramolecular charge-order state. (Dept.Appl.Chem.,Grad.Sch.Sci.,Eng.,Ehime Univ.)*Naoya Kinoshita,Syogo Katayama,Yusuke Oka,Takasi Sirahata,Yoji Misaki |
| 13:10-14:40 | 1P054 | Synthesis, structures, and physical properties of hydrogen-bonded novel charge transfer complexes based on catechol-fused TTF (ISSP, The University of Tokyo1,KEK PF/CMRC2)*Ryohei Doi1,Akira Ueda1,Reiji Kumai2,Youichi Murakami2,Hatsumi Mori1 |
| 13:10-14:40 | 1P055 | Development of new magnetic conductors using cation radical salts of TTF derivatives containing a stable organic radical (Osaka Prefecture Univercity)*Kazuki Horikiri,Hideki Fujiwara |
| 13:10-14:40 | 1P056 | Photoinduced magnetic properties of TTF derivatives including a stable organic radical (Grad. School of Sci. and Tech. Niigata Univ.1,Center for Instrumental Analysis, Niigata Univ.2,Grad. School of Sci., Osaka Prefecture Univ.3)*Masanori Abe1,Ko Furukawa1,2,Kazuki Horikiri3,Hideki Fujiwara3 |
| 13:10-14:40 | 1P057 | Synthesis and characterization of charge transfer complex based on C3-symmetric donor molecule (Graduate School of Science, Kyoto Univ.1,HSE, Kyoto Univ.2,IMS3)*Yoshiaki Nakano1,Yoshiki Oe1,Manabu Ishikawa1,2,Hideki Yamochi1,Mikio Uruichi3 |
| 13:10-14:40 | 1P058 | Development of novel electron-accepting ligands and their complexes (Grad. Sch. Sci., Kobe Univ.)*Masatoshi Hirano,Kazuyuki Takahashi |
[Surface/Interface]
| 13:10-14:50 | 1P059 | Molecular Structure at the Hydrophilic TiO2/Water Interface Studied by Heterodyne-Detected Sum Frequency Generation Spectroscopy (Molecular Spectroscopy Laboratory, RIKEN1,Ultrafast Spectroscopy Research Team, RIKEN Center for Advanced Photonics2)*Anton Myalitsin1,Satoshi Nihonyanagi1,2,Tahei Tahara1,2 |
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| 13:10-14:50 | 1P060 | Vibrational signature of water molecules at charged silica/aqueous interface revealed by heterodyne-detected vibrational sum frequency generation spectroscopy: water structure inside the Helmholtz layer (Molecular spectroscopy lab., RIKEN1,Ultrafast spectrscopy research team, RAP2)*Shu-hei Urashima1,Satoshi Nihonyanagi1,2,Tahei Tahara1,2 |
| 13:10-14:50 | 1P061 | Infrared-visible sum-frequency generation vibrational spectroscopy and molecular dynamics simulation studies on liquid/liquid interfaces of alcohols and ionic liquids (School of Materials and Chemical Technology, Tokyo Tech.1,Graduate School of Science and Engineering, Univ. of Toyama2,Graduate School of Science, Tohoku Univ.3,Elements Strategy Initiative for Catalysts and Batteries, Kyoto Univ.4,Sogang Univ.5)*Takashi Iwahashi1,Tatsuya Ishiyama2,Akihiro Morita3,4,Doseok Kim5,Yukio Ouchi1 |
| 13:10-14:50 | 1P062 | Structure of metal ion-crown ether complexes at the organic/water interface investigated by SEIRA spectroscopy and electrochemical measurement (Graduate School of Science, Hiroshima Univ.1,IMS2)*Takumi Honda1,Yuji Furutani2,Takeharu Haino1,Takayuki Ebata1,Yoshiya Inokuchi1 |
| 13:10-14:50 | 1P063 | Aggregation of a BiVO4 single crystal with Ru/SrTiO3:Rh particles by light irradiation and its effect on carrier dynamics (Graduate School of Science, Kyoto Univ.1,Tokyo University of Science2)*Atsuhiro Takeda1,Shinpei Norioka1,Toshiki Sugimoto1,Kazuya Watanabe1,Akihiko Kudo2,Yoshiyasu Matsumoto1 |
| 13:10-14:50 | 1P064 | Unoccupied electronic states of 3d-transition metal phthalocyanine thin films (Saga SLAC)*Isamu Yamamoto,Hayata Watanabe,Junpei Azuma,Masaki Imamura,Kazutoshi Takahashi,Masao Kamada |
| 13:10-14:50 | 1P065 | Temperature effect on electronic structure and electron dynamics of DBP on HOPG (Osaka Univ.)*Shogo Kunieda,Ryosuke Mori,Takashi Yamada,Hiroyuki Kato,Toshiaki Munakata |
| 13:10-14:50 | 1P066 | Current status of development of an electrochemical cell for soft x-ray spectroscopy at SPring-8 BL17SU (RIKEN SPring-8 Center, RIKEN1,Faculty of Environmental Earth Science, Hokkaido Univ.2)*Takashi Tokushima1,Ichizo Yagi2 |
| 13:10-14:50 | 1P067 | Determination of charge injection barrier of Poly(3-hexylthiophene) using displacement current method (Science, University of Hyogo)*Hisaki Nakatani,Seichi Satou,Hiroyuki Tajima,Naoto Yasukawa |
| 13:10-14:50 | 1P068 | Electrochemical modification of molecules at graphene/metal single crystalline surfaces (Faculty of Environmental Earth Science, Hokkaido Univ,1,Graduate School of Environmental Science, Hokkaido Univ.2)*Ichizo Yagi1,2,Shun Tanno2,Yusuke Sato1,Masaru Kato1,2 |
| 13:10-14:50 | 1P069 | Elucidation of heterogeneous photon-to-current conversion dynamics in dye-sensitized solar cells using scanning photocurrent and photoluminescent microscopy (Graduate School of Science, Rikkyo Univ.)*Kyosuke Mori,Masaaki Mitsui |
| 13:10-14:50 | 1P070 | Molecular mechanism of interfacial adhesion between epoxy resin and glass surface (IMCE, Kyushu Univ.)*Chisa Higuchi,Hiroyuki Murata,Takayuki Semoto,Hiromasa Tanaka,Kazunari Yoshizawa |
| 13:10-14:50 | 1P071 | Potential-dependent Structure of Electric Double Layer Formed at Electrolyte Solution / Graphite Electrode Interfaces Analyzed by Molecular Dynamics Simulation (Graduate School of Engineering Science, Osaka Univ.1,Riken2,Graduate School of Engineering, Osaka Univ.3)*Masaya Imai1,Yasuyuki Yokota2,Ichiro Tanabe1,Yoshitada Morikawa3,Koji Inagaki3,Ken-ichi Fukui1 |
[Clusters/particles/nanostructures]
| 13:10-14:50 | 1P072 | Systematic search for structures of [Rhx(NO)y]z+ clusters: structure and reactivity (Graduate School of Science, Hokkaido Univ.)*Tomoya Ichino,Satoshi Maeda,Tetsuya Taketsugu |
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| 13:10-14:50 | 1P073 | Theoretical proposal for Pt-common metal alloying toward improving the catalytic activity of subnanosized Pt-clusters: An element strategy (Dept. of Chemistry and Biochemistry, Ochanomizu Univ1,Faculty of core research, Natural science dirisition, Ochanomizu Univ2)*Kasumi Miyazaki1,Hirotoshi Mori2 |
| 13:10-14:50 | 1P074 | Reactivity of transition-metal-doped silver cluster cations influenced by size-dependent s-d hybridization (Faculty of Science, Kyushu Univ.)*Shun Sarugaku,Jumpei Matsumoto,Tomoki Kawano,Masashi Arakawa,Akira Terasaki |
| 13:10-14:50 | 1P075 | Optical absorption spectroscopy of silver cluster cations: Measurement of absorption cross sections by the photon-trap technique (Department of Chemistry, Kyushu University)*Yuya Kiyomura,Kenichiro Tobita,Masashi Arakawa,Akira Terasaki |
| 13:10-14:50 | 1P076 | Evaporation and subsequent adsorption of alcohol molecules at the air/water interface observed by cavity enhanced Raman spectroscopy (Graduate School of Science, Gakushuin Univ.)*Yasuhito Kihara,Hiroya Asami,Jun-ya Kohno |
| 13:10-14:50 | 1P077 | Morphology dependence of multiorder stokes raman emission from liquid droplet (Graduate School of Science, Gakushuin Univ)*Kosuke Negishi,Jun-ya Kohno |
| 13:10-14:50 | 1P078 | Intermolecular proton transfer reactions in ethanol droplets under fast ion irradiation (Graduate School of engineering, Kyoto Univ.)*Kensei Kitajima,Takuya Majima,Yoshiki Oonishi,Hidetsugu Tsuchida,Akio Itoh |
| 13:10-14:50 | 1P079 | Hydrogen-Bonding Molecular Assemblies of Alkylamide-Substituted Isophthalic Acid Derivative (Graduate School of Engineering, Tohoku Univ.1,Institute of Multidisciplinary Research for Advanced Materials (IMRAM), Tohoku Univ.2)*Chao Lv1,Takashi Takeda1,2,Norihisa Hoshino1,2,Tomoyuki Akutagawa1,2 |
| 13:10-14:50 | 1P080 | Formation of metal nanoparticles in ionic liquid confined in nano-pore by X-ray irradiation-induced reduction (Graduate School of Engineering Science, Osaka Univ.1,Graduate School of Engineering, Osaka Univ.2)*Naoko Oda1,Chisato Kimoto1,Takashi Arimura1,Tetsuya Tsuda2,Susumu Kuwabata2,Ken-ichi Fukui1,Akihito Imanishi1 |
| 13:10-14:50 | 1P081 | Excited states and photophysical properties of thiolate-protected icosahedral gold cluster (Department of Chemistry, Faculty of Science, Hokkaido University1,Department of Chemistry, Faculty of Science, Hokkaido University2)*Masanori Ebina1,Takeshi Iwasa2,Tetsuya Taketsugu2 |
| 13:10-14:50 | 1P082 | Elucidation of the effect of precise control of cocatalyst on the photocatalytic activity and exploration of effective methods for high activation (Graduate School of Chemical Sciences and Technology, Tokyo Univ. of Sci.1,Tokyo Univ. of Sci.2)*Rina Kumazawa1,Wataru Kurashige1,2,Daiki Ishii1,Tomoaki Takayama2,Akihide Iwase1,2,Akihiko Kudo1,2,Yuichi Negishi1,2 |
| 13:10-14:50 | 1P083 | Characterization of oxygen reduction reaction of size and chemical composition controlled metal clusters (Graduate School of Chemical Sciences and Technology, Tokyo Univ.of Sci.1,Tokyo Univ.of Sci.2)*Juri Maekawa1,Bharat Kumar1,Atsuya Harasawa1,Wataru Kurashige1,2,Yuichi Negishi1,2 |
| 13:10-14:50 | 1P084 | Synthesis of copper nanoparticles adsorbed on layered clay minerals without capping agents (Chuo Univ.)*Masaya Miyagawa,Akane Shibusawa,Kaho Maeda,Hideki Tanaka |
| 13:10-14:50 | 1P085 | Ultra‐small Reducing Capsule based on BH3 units (Laboratory for Chemistry and Life Science Tokyo Institute of Technology)*Tetsuya Kambe,Takane Imaoka,Kimihisa Yamamoto |
| 13:10-14:50 | 1P086 | Zn-doped CdS nanowires derived from coordination polymers (Department of Chemistry, Faculty of Science, Hokkaido Univ.1,Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.2,Graduate School of Science, Hokkaido Univ.3)*Shinya Tajima1,Yoshiki Kuroshima2,Kenji Hirai3,Kazuki Sada3 |
| 13:10-14:50 | 1P087 | Modeling and spectral simulation of matrix-isolated molecules by density functional calculations (3) (AIST)*Fumiyuki Ito |
| 13:10-14:50 | 1P088 | Theoretical Study on Excitation Dynamics in Organic Nano Crystal (Center of Comput. Sci., Tsukuba Univ.)*Hirotaka Kitoh-nishioka,Yasuteru Shigeta |
| 13:10-14:50 | 1P089 | Design of nanowire materials for enhancement of thermoelectric properties (C-PiER, Kyoto Univ.)*Koichi Nakamura |
| 13:10-14:50 | 1P090 | Density functional theory calculations of on orientation of dimethylaminonitrostilbene inside carbon nanotubes (Kyoto Institute of Technology)*Wataru Yamamoto,Takashi Yumura,Takashi Wakasugi |
[Biomolecules]
| 13:10-14:50 | 1P091 | Theoretical study for oxidation reaction of firefly luciferin (ISSP, Univ. Tokyo1,Nagoya Univ.2)*Miyabi Hiyama1,Hidefumi Akiyama1,Nobuaki Koga2 |
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| 13:10-14:50 | 1P092 | Development of the pressure variable light-induced FTIR measurement system (Institute for Molecular Science1,Equipment Development Center (Institute for Molecular Science)2)*Kunisato Kuroi1,Sachiyo Kimura2,Masaki Aoyama2,Yuji Furutani1 |
| 13:10-14:50 | 1P093 | Light adaptation of a green alga Chlamydomonas reinhardtii, probed by time-resolved fluorescence spectroscopy (Graduate School of Science, Kobe Univ.1,Graduate School of Engineering, Kobe Univ.2,Molecular Photoscience Research Center, Kobe Univ.3)*Ayano Sekido1,Shimpei Aikawa2,Akihiko Kondo2,Seiji Akimoto1,3 |
| 13:10-14:50 | 1P094 | Photoreaction dynamics of light responsive DNA studied by the transient grating method (Graduate School of Science, Kyoto Univ.1,Graduate School of Engineering, Nagoya Univ.2)*Wataru Hashimura1,Yusuke Nakasone1,Hideaki Ooi2,Yukiko Kamiya2,Hiroyuki Asanuma2,Masahide Terazima1 |
| 13:10-14:50 | 1P095 | Excitation energy transfer processes from phycobilisomes to photosystems probed by picosecond time-resolved fluorescence spectroscopy (Graduate School of Science, Kobe Univ.1,Graduate School of Engineering, Kobe Univ.2,Molecular Photoscience Research Center, Kobe Univ.3)*Yoshifumi Ueno1,Shimpei Aikawa2,Akihiko Kondo2,Seiji Akimoto1,3 |
| 13:10-14:50 | 1P096 | Development of single-molecule electrical detection method for bio-polymer identification (ISIR, Osaka University)*Takahito Ohshiro,Makusu Tsutsui,Kazumichi Yokota,Masateru Taniguchi |
| 13:10-14:50 | 1P097 | Time resolved EPR study on the orientation of the primary charge separation of the PSII reaction center (Graduate School of Science, Kobe Univ.1,Graduate School of Science, Nagoya Univ.2,Graduate School of Science, Shizuoka Univ.3)*Reina Minobe1,Masashi Hasegawa1,Shusuke Katagiri3,Takahiro Sakai2,Hiroki Nagashima2,Takashi Tachikawa1,Hiroyuki Mino2,Yasuhiro Kobori1 |
| 13:10-14:50 | 1P098 | Chemical components analysis of nitrate sludges and anaerobic granules used in wastewater treatment by Raman microspectroscopy (Graduate School of Science and Technology, Kwansei Gakuin Univ.1,Graduate School of Life and Environment Science, Tsukuba Univ.2,University of Zurich3)*Yosuke Shimabata1,Masanori Toyohuku2,3,Nobuhiko Nomura2,Shinsuke Shigeto1 |
| 13:10-14:50 | 1P099 | The consideration of the resolution of super-resolution microscopy with annular wave plate (NTT Advanced Technology Corporation1,Kitasato University2,Budapest University of Technology and Economics3,OLYMPUS CO., LTD4)*Koumei Nagai1,Satoshi Oku1,Akira Kodaira1,Hiroshi Kumagai2,Nandor Bokor3,Yoshinori Iketaki2,4 |
| 13:10-14:50 | 1P100 | Theoretical molecular dynamics simulation of the DIF-1 receptor activation (Sophia Univ.)*Tenryu Kyo,Nanbu Shinkoh,Tamao Saito |
| 13:10-14:50 | 1P101 | Conformation change of ubiquitin ion probed by proton transfer reaction (Graduate School of Nanobioscience, Yokohama City University)*Taiju Tanimura,Hiroki Akiyama,Masato Miyazawa,Hayato Sasaoka,Shinji Nonose |
| 13:10-14:50 | 1P102 | Theoretical study on mechanism of copper- and zinc- containing superoxide dismutase (Graduate School of Life and Enviromental Sciences1,Gradurate School of Engineering Department of Symthetic chemistry2)*Chiaki Yamada1,Masami Lintuluoto1,Juha Lintuluoto2 |
| 13:10-14:50 | 1P103 | Development of orbital interaction analysis method for investigating enzymatic reaction mechanism (Kyushu Univ.1,JST-CREST2)*Yuuichi Orimoto1,Yuriko Aoki1,2 |
| 13:10-14:50 | 1P104 | Molecular spectroscopic imaging of human skin ex vivo using multiplex CARS microspectroscopic device (Graduate School of Pure and Applied Sciences University of Tsukuba1,Shiseido Global Innovation Center2)*Masahiro Kimura1,Hiroaki Yoneyama1,Mariko Egawa2,Shinya Iwanaga2,Junichi Hosoi2,Hideaki Kano1 |
[Theory/calculation]
| 13:10-14:50 | 1P105 | Theoretical study about rate constants for amine [(CH3)nNH(3-n), n = 1,2,3] and O3. (NIES1,Hokkaido Univ.2,JST-CREST3)*Ayako Furuhama1,Takashi Imamura1,Satoshi Maeda2,3,Tetsuya Taketsugu2,3 |
|---|---|---|
| 13:10-14:50 | 1P106 | High-level ab initio calculations of gold monosulfide, AuS (Shizuoka Univ.1,Ochanomizu Univ.2)*Emi Okabayashi1,Toshiaki Okabayashi1,Tsuneo Hirano2 |
| 13:10-14:50 | 1P107 | Path Integral Molecular Dynamics Study of Muoniated Radical (Graduate School of Nanobioscience, Yokohama City University)*Yuki Oba,Tsutomu Kawatsu,Masanori Tachikawa |
| 13:10-14:50 | 1P108 | A computational study for the NMR maginetic shielding constant of H2/HD@C60 fullerene (Nanobio., YCU)*Tsutomu Kawatsu,Masanori Tachikawa |
| 13:10-14:50 | 1P109 | Optimal control of selective photodissociation of IBr by the non-resonant dynamic stark effect (Graduate School of Science, Tohoku Univ.)*Tomohiro Tashiro,Masataka Yoshida,Yukiyoshi Ohtsuki,Hirohiko Kono |
| 13:10-14:50 | 1P110 | VSCF-CI calculations of strongly coupled systems (Graduate school of science, TMU.1,The Open University of Japan2)*Hibiki Iwase1,Kenro Hashimoto1,2 |
| 13:10-14:50 | 1P111 | Rotational effects on the quantum control of molecular isomerization (National institute for quantum and radiological science and technology1,Princeton university2)*Yuzuru Kurosaki1,Tak-san Ho2,Herschel Rabitz2 |
| 13:10-14:50 | 1P112 | Analysis of fused cubic (H2O)12 based on LPMO PT: Correlation of charge-transfer term with hydrogen bond network (Graduate School of Science, Hiroshima Univ.1,Center for Quantum Life Sciences2,Keio Univ.3)*Dai Akase1,2,Misako Aida1,2,Suehiro Iwata3 |
| 13:10-14:50 | 1P113 | Theoretical calculations for inner-shell excitation dissociation process of the valence excitation benzoic acid molecule (Graduate School of Physical Science, Hiroshima Univ.1,Sustainable Development Practice Research Center, Hiroshima Univ.2)*Haruka Inui1,Atsunari Hiraya1,Osamu Takahashi2 |
| 13:10-14:50 | 1P114 | Development of ab initio semiclassical MD method (Graduate School of Science and Technology, Sophia Univ.1,Institute of Physics, National Chiao Tung Univ.2,Institute of Molecular Science, National Chiao Tung Univ.3,Nakamura Institute of Chemical Dynamics4)*Ayumi Ohta1,Shinkoh Nanbu1,Yoshiaki Teranishi2,Hiroki Nakamura3,4 |
| 13:10-14:50 | 1P115 | Estimation of the pseudo-Jahn-Teller terms using non-adiabatic coupling integrals (Osaka Prefecture University1,The research institute for molecular electronic devices2,MIyagi University of Education3,Long Island University4)*Shiro Koseki1,2,Azumao Toyota3,Takashi Muramatsu3,Toshio Asada1,2,Nikita Matsunaga4 |
| 13:10-14:50 | 1P116 | Conformational entropy in intra Diels-Alder reactions (Hokkaido Univ.1,Hokkaido Univ.2)*Yosuke Sumiya1,Satoshi Maeda2,Tetsuya Taketsugu2 |
| 13:10-14:50 | 1P117 | Theoretical study of 2-hydroxyacrylophenone cyclization reaction (Graduate School of Science and Engineering, Sophia Univ.)*Yoko Kagaya,Sodai Takashima,Osamu Kobayashi,Shinkoh Nanbu |
| 13:10-14:50 | 1P118 | Theoretical investigation on photoexcitation dynamics of bis(diimine)copper(Ⅰ) complex with molecular simulations (Graduate School of Engineering and Science, Univ. of the Ryukyus1,Graduate School of Information Science, Nagoya Univ.2,Faculty of Science, Univ. of the Ryukyus3)*Asaka Agena1,Satoru Iuchi2,Masahiro Higashi3 |
| 13:10-14:50 | 1P119 | Ab initio molecular dynamics simulation of IR spectra of sulfonic acid hydrates in crystals and nonaqueous solutions (FC-Cubic)*Makoto Yamaguchi |
| 13:10-14:50 | 1P120 | A theoretical study on fluctuation of supercritical CO2 by molecular dynamics simulation using effective fragment potential (Department of Chemistry and Biochemistry, Graduate School of Humanities and Sciences, Ochanomizu Univ.1,Faculty of Core Research Natural Science Division, Ochanomizu Univ.2)*Nahoko Kuroki1,Hirotoshi Mori2 |
| 13:10-14:50 | 1P121 | Theoretical study on triplet-triplet annihilation based low-power photon up-conversion mechanism with modified DPA (Center for computational Sciences, Tsukuba Univ1,Department of Materials and Chemistry, AIST2,Graduate School of Engineering Science, Osaka Univ3)*Ryuma Sato1,Kenji Kamada2,Ryohei Kishi3,Yasutaka Kitagawa3,Masayoshi Nakano3,Yasuteru Shigeta1 |
| 13:10-14:50 | 1P122 | Molecular dynamics simulations and theoretical analysis of liquid pyrenes (Graduate School of Science, Kyoto Univ.1,International Center for Materials Nanoarchitectonics2)*Yuki Yamamoto1,Fengniu Lu2,Takashi Nakanishi2,Shigehiko Hayashi1 |
| 13:10-14:50 | 1P123 | Molecular dynamics study on recrystallization of water in solid polymer (Graduate School of Science & Enginearing, Univ. of Toyama)*Nobuhiro Yasoshima,Makoto Gemmei-ide,Tatsuya Ishiyama |
| 13:10-14:50 | 1P124 | Theoretical study on Friedel Crafts alkylation: the effect of co-catalyst on regioselectivity (Hokkaido Univ.1,Hokkaido Univ.2)*Masashi Sampei1,Yosuke Sumiya1,Satoshi Maeda2,Tetsuya Taketsugu2 |
| 13:10-14:50 | 1P125 | A theoretical study of heat storage capacity, density, and temperature of thermal energy storage materials (X(OH)2, XCO3 (X=Mg, Ca, Sr, Ba)) (AIST,CD-FMat1,Thermal Management Materials and Technology Research Association2,Toyota Motor Corporation3)*Shinya Tsukamoto1,2,Yoshio Ohashi3,Mamoru Ishikiriyama3,Toyokazu Ishida1,2 |
| 13:10-14:50 | 1P126 | Quantum master equation approach to singlet fission dynamics (Graduate School of Engineering Science, Osaka Univ.1,Graduate School of Science, Osaka Univ.2)*Masayoshi Nakano1,Takanori Nagami1,Soichi Ito1,Takashi Kubo2 |
| 13:10-14:50 | 1P127 | Theoretical study on the effect of static electric field application on nonlinear optical properties of π-radical dimer (Graduate School of Engineering Science, Osaka Univ.)*Hiroshi Matsui,Matsushita Naoyuki,Kotaro Fukuda,Yuka Minamida,Takanori Nagami,Masayoshi Nakano |
| 13:10-14:50 | 1P128 | Residual entropy of ordinary ice calculated from multicanonical Monte Carlo simulations II (Department of International Liberal Studies,Chukyo University1,Department of Physics, Graduate School of Science, Nagoya University2,Department of Physics, Florida State University3)*Chizuru Muguruma1,Takuya Hayashi2,B. a. Berg3,Yuko Okamoto2 |
| 13:10-14:50 | 1P129 | LC-DFT Calculations on Crystal Systems (RIKEN AICS)*Yukio Kawashima,Kimihiko Hirao |
| 13:10-14:50 | 1P130 | Theoretical studies of carrier diffusion in tantalum oxynitride perovskite photocatalyst (School of Engineering, Univ. of Tokyo1,CREST-JST2)*Hiroki Iriguchi1,2,Eriko Watanabe1,Koichi Yamashita1,2 |
| 13:10-14:50 | 1P131 | Exploration of Boron Nitride Crystal Structures by Artificial Force Induced Reaction Method (Graduate School of Chemical Sciences and Engineering, Hokkaido Univ1,Graduate School of Science, Hokkaido Univ2,JST-CREST3)*Makito Takagi1,Satoshi Maeda2,3,Tetsuya Taketsugu2 |
| 13:10-14:50 | 1P132 | Path integral study of static properties of ice Ic (Division of Chemistry, Graduate School of Humanities and Sciences, Nara Women’s University)Naoka Sato,*Kenichi Kinugawa |
| 13:10-14:50 | 1P133 | Exploration of structures of SiC having low dimensional and translational symmetry (Graduate School of Systems Engineering, Wakayama Univ.1,Faculty of Systems Engineering, Wakayama Univ.2,Institute for Quantum Chemical Exploration3,Graduate School of Science, Tohoku Univ.4)*Yuuki Midoro1,Hideo Yamakado2,Koichi Ohno3,4 |
| 13:10-14:50 | 1P134 | A Theoretical Modelling of High-dielectric-constant Donors Based on Periodic Boundary Condition Calculations (Graduate School of Engineering, The University of Tokyo1,JST-CREST2)*Kenji Mishima1,Koichi Yamashita1,2 |
| 13:10-14:50 | 1P135 | Theoretical investigation of salt concentration effect on solid electrolyte interphase (SEI) film formation in Na-ion batteries (Graduate School of Information Science, Nagoya Univ.1,ESICB, Kyoto Univ.2,CREST-JST3)*Norio Takenaka1,2,Masataka Nagaoka1,2,3 |
| 13:10-14:50 | 1P136 | Development of hybrid MC/MD reaction method based on QM/MM method: Application to solid electrolyte interphase (SEI) film formation in secondary batteries (Graduate School of Information Science, Nagoya Univ.1,ESICB, Kyoto Univ.2,CREST-JST3)*Takuya Fujie1,Norio Takenaka1,2,Yuichi Suzuki1,Masataka Nagaoka1,2,3 |
| 13:10-14:50 | 1P137 | Exploring pathways of CO oxidation on Pt(111) by the Artificial Force Induced Reaction method (Hokkaido Univ.1,Hokkaido Univ.2,Hokkaido Univ.3)*Kanami Sugiyama1,Makito Takagi2,Yosuke Sumiya2,Satoshi Maeda3,Tetsuya Taketsugu3 |
| 13:10-14:50 | 1P138 | Entropic Effect on Charge Separation of Organic Photovoltaics (Graduate School of Engineering, Univ. of Tokyo1,CREST, JST2)*Eisuke Kawashima1,2,Mikiya Fujii1,2,Koichi Yamashita1,2 |
| 13:10-14:50 | 1P139 | First-Principles study of electrolyte decomposition reaction on the surface of LiNi0.5Mn1.5O4 (FUJIFILM Corporation)*Yukihiro Okuno,Keisuke Ushirogata |
| 13:10-14:50 | 1P140 | Theoretical study on inhomogeneous hydrogen bonding at graphene/water interface (INAMORI Fronier Research Center, Kyushu University)*Takayoshi Ishimoto,Michihisa Koyama |
| 13:10-14:50 | 1P141 | Ring-polymer molecular dynamics study of photoexcitation of the silver atom in helium clusters (Graduate School of Science, Saitama Univ.1,JAEA2)*Yusuke Seki1,Takahiko Yoshida1,Toshiyuki Takayanagi1,Motoyuki Shiga2 |
| 13:10-14:50 | 1P142 | Informatics study for correlation between electronic properties and catalytic activities of metal nano-clusters (Hokkaido Univ.1,Kyoto Univ. ESICB2,JST-PERSTO3,Hokkaido Univ.4,NIMS GREEN5,JST-CREST6)*Takeshi Iwasa1,2,Masato Kobayashi1,2,3,Takaaki Sato4,Min Gao1,2,Makito Takagi4,Andrey Lyalin5,Satoshi Maeda1,2,6,Tetsuya Taketsugu1,2,5 |
| 13:10-14:50 | 1P143 | Spin contamination error in optimized molecular geometry of dinuclear metal complexes (Graduate School of Engineering Science, Osaka Univ.)*Yasutaka Kitagawa,Koji Miyagi,Mizuki Asaoka,Rena Teramoto,Yoshiki Natori,Masayoshi Nakano |
| 13:10-14:50 | 1P144 | Theoretical investigation on the chlorine elimination in the preparation processes of gold catalysts (AIST1,ESICB2,Osaka Univ.3)*Kohei Tada1,3,Hiroaki Koga2,Yudai Kondo3,Yoshinori Ato3,Akihide Hayashi3,Takashi Kawakami3,Shusuke Yamanaka3,Shingo Tanaka1,Mitsutaka Okumura3,2 |
| 13:10-14:50 | 1P145 | Development of closed- and open-shell elongation method and its applications to functional nanowires (Faculty of Engineering Sciences, Kyushu Univ.1,JST-CREST2)*Yuriko Aoki1,2,Wataru Mizukami1,Yuuichi Orimoto1,Kai Liu1 |
| 13:10-14:50 | 1P146 | Electron transfer in complexes of buckyball and a molecular chatcher (Dept. of Mathematical and Physical Sciences, Japan Women's Univ.)Chiaki Hiraiwa,*Azusa Muraoka |
| 13:10-14:50 | 1P147 | Effects of an anion on the hydrogen bond between water and water in the halide ion-water cluster (Dept. of Chem., Faculty of Sci. and Tech., Keio Univ.1,Dept. of App. Chem.,Faculty of Eng., Chiba Inst. of Tech.2)*Chiaki Ishibashi1,2,Suehiro Iwata1,Hidenori Matsuzawa2 |
| 13:10-14:50 | 1P148 | Theoretical study of correlations between structures and catalytic activities in Polymer-stabilized Au Nano-cluster Catalysis (Graduate School of Science,Osaka Univ.)*Yoshinori Ato,Akihide Hayashi,Takashi Kawakami,Shusuke Yamanaka,Mitsutaka Okumura |
| 13:10-14:50 | 1P149 | Prediction of Pt NMR chemical shift in Pt complex by ab initio calculation (Toyota Motor Corporation1,Toyota Central R&D Labs2)*Ishikura Maiko1,Shirai Soichi2,Sugimoto Tsuyoshi1,Nobuko Ohba2,Sato Naoki1,Kato Hitoshi1,Morohoshi Kei1 |
| 13:10-14:50 | 1P150 | Theoretical study of the quenching process of the lanthanide luminescent materials (Kindai Univ.1,JST PRESTO2)*Miho Hatanaka1,2 |