Poster Sessions

Tuesday, September 24 (Starting at 13:00)

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

[Gas phase]

13:00-14:50 1P001 Fourier-transform microwave spectroscopy of AgOH and AgSH
(Faculty of Science, Shizuoka Univ.)*Hisashi Hashimoto,Hirohumi Kubota,Toshiaki Okabayashi
13:00-14:50 1P002 Fourier-transform microwave spectroscopy of AgCN and AuCN
(Faculty of Science, Shizuoka Univ.)*Hirofumi Kubota,Aya Nakane,Toshiaki Okabayashi
13:00-14:50 1P003 Nitrogen nuclear quadrupole coupling constants of n-methylacetamide
(Graduate School of Natural Science &Technology Kanazawa UniVersity)*Yohei Uchida,masaharu Fujitake
13:00-14:50 1P004 Discharge emission spectrum and the torsional vibration of the butatriene cation H2CCCCH2+
(Graduate School of Synthesis Chemistry, Tokyo University of Scienece1,Faculty of Scienece, Tokyo University of Scienece2)*Satoshi Uchida1,Mitsunori Araki1,Yuuki Matsushita1,Norihisa Kondo2,Koichi Tsukiyama1
13:00-14:50 1P005 Pressure broadening of rotational lines of HO2 radical in mid-infrared absorption
(Graduate School of Frontier Science, Univ. of Tokyo1,Faculty of Environmental Earth Science, Hokkaido Univ.2,Faculty of Science, Tokyo Univ. of Science3)*Maya Minamida1,Yosuke Sakamoto2,Kenichi Tonokura1,Koichi Tsukiyama3
13:00-14:50 1P006 Dependence of collisional rotational linewidth of HO2 radical by collisions with rare gases
(Tokyo Institute of Technology)Kota Kuribayashi,*Asao Mizoguchi,Hideto Kanamori
13:00-14:50 1P007 Plasma diagnostics for secondary particles induced by high power impulse magnetron sputtering
(Tohoku Univ.1,Tohoku Univ.2,Ayabo Corporation3)*Tetsuro Tamura1,Yoshinori Nakamura2,Isamu Mizuuchi2,Masahide Tona3,Kiichirou Koyasu1,Keijiro Ohshimo1,Keizo Tsukamoto1, 3,Fuminori Misaizu1
13:00-14:50 1P008 Ground electronic state of the chromium dimer cation: Consideration based on symmetry
(Genesis Research Institute1,Yokohama City Univ.2,Toyota Technological Institute3,Kyushu Univ.4)*Kazuhiro Egashira1,Yurika Yamada2,Yukiumi Kita2,Masanori Tachikawa2,Akira Terasaki3, 4
13:00-14:50 1P009 Ring polymer molecular dynamics simulation for non-adiabatic relaxation mechanisms of hydrated electron cluster.
(Graduate School of Science and Engineering, Saitama Univ.)*Takehiro Yoshikawa,Toshiyuki Takayanagi
13:00-14:50 1P010 Superoxide chemistry in O2/CO2/NO system: Formation and structure of ONOOCO2-
(Graduate School of Arts and Sciences, Univ. of Tokyo)*Ryuzo Nakanishi,Takashi Nagata
13:00-14:50 1P011 Development of a photofragment velocity-map imaging spectrometer for mass-selected cluster ions
(Graduate School of Informatics and Engineering, UEC1,Faculty of Informatics and Engineering, UEC2)*Yoshihiro Yamakita1,Kodai Saito1,Noriaki Kobayashi1,Shota Shimokawara2
13:00-14:50 1P012 C 1s photoelectron angular distribution from iodomethane molecules in the molecular frame
(IMRAM, Tohoku Univ.1,RSC2,Graduate School of Science, Kyoto Univ.3,AIST, NMIJ4)*Shuhei Yamada1, 2,Hironobu Fukuzawa1, 2,Tetsuya Tachibana1, 2,Yuta Ito1, 2,Kiyonobu Nagaya2, 3,Toshiyuki Nishiyama2, 3,Tsukasa Sakai2, 3,Makoto Yao3,Masaki Oura2,Norio Saito2, 4,Kiyoshi Ueda1, 2
13:00-14:50 1P013 Infrared spectroscopic investigations on the dissociation process of the protonated diethylether
(Graduate School of Science, Tohoku Univ.)*Tomoya Endo,Yoshiyuki Matsuda,Asuka Fujii
13:00-14:50 1P014 Infrared spectroscopy of protonated trimethylamine-(benzene)n clusters:CH/pi interaction and cation/pi interaction
(Graduate School of Science, Tohoku Univ.)*Yuki Kawai,Ryunosuke Shishido,Asuka Fujii
13:00-14:50 1P015 Infrared spectroscopy of large protonated and neutral ammonia clusters (H+(NH3)n and (NH3)n) (n=8-50)
(Graduate School of Science, Tohoku Univ.)*marusu Katada,ryunosuke shishido,Asuka Fujii
13:00-14:50 1P016 Infrared spectroscopy of the H2S clusters: The hydrogen-bond donor ability of S-H bond
(Department of Chemical Sciences, Tata Institute of Fundamental Research1,Graduate School of Science, Tohoku University2,Center for the Advancement of Higher Education, Tohoku University3)Aditi Bhattacherjee1,*Yoshiyuki Matsuda2, 3,Asuka Fujii2,Sanjay Wategaonkar1
13:00-14:50 1P017 Structure determination of 1-naphthol–ammonia clusters in the S1 state by mid-IR dip spectroscopy –toward determination of the size dependence of the excited state proton transfer reaction–
(Chemical Resources Lab. Tokyo Tech.)*Shunpei Yoshikawa,Toshihiko Shimizu,Ruriko Yoshino,Shun-ichi Ishiuchi,Mitsuhiko Miyazaki,Masaaki Fujii
13:00-14:50 1P018 Study of the N-H...O=C hydrogen-bonded structures of dimethylpyrrole-ketone binary clusters by IR spectroscopy
(Graduate School of Material Science, Univ. Hyogo)*Yuuta Kameyama,Sunao Murakami,Yoshiteru Matsumoto,Kenji Honma
13:00-14:50 1P019 Observation of femtosecond laser-assisted electron diffraction of CCl4 and determination of its instantaneous geometrical structure
(School of Science, The University of Tokyo)*Yuya Morimoto,Reika Kanya,Kaoru Yamanouchi
13:00-14:50 1P020 [canceled] Observation of N2 C-B (0,0) transition in a femtosecond laser induced filament in air by emission spectroscopy
(the univ of Tokyo1,the Institut d'Optique Graduate School2)*Ryota Ishihara1,Laurent HUOT2,Sigeki Oowada1,Takahiro Sato1,Atsushi Iwasaki1,Kaoru Yamanouchi1
13:00-14:50 1P021 The carrier envelop phase dependence of few-cycle laser pulses on Coulomb explosion processes of acetylene molecules
(School of Science, UT1,Institut fuer Optik und Quantenelektronik, Friedrich-Schiller-Universitaet2,Photonics Institute, Vienna University of Technology3,Department of Physics, Politecnico di Milano4)*Shun Miura1,Toshiaki Ando1,Kazuki Ootaka1,Atsushi Iwasaki1,Huailiang Xu1,Tomoya Okino1,Kaoru Yamanouchi1,Dominik Hoff2,Tim Rathje2,Gerhard Paulus2,Markus Kitzler3,Andrius Baltuska3,Giuseppe Sanzone4,Mauro Nisoli4
13:00-14:50 1P022 Dissociation of methane in intense laser fields studied by pump-probe coincidence momentum imaging
(School of Science, The University of Tokyo)*Akihiro Shimamoto,Toshiaki Ando,Shun Miura,Atsushi Iwasaki,Kaoru Yamanouchi
13:00-14:50 1P023 [canceled] Angular correlation and structure of conjugate Fermi hole in He-like atoms
(CST, Nihon Univ.)*Tokuei Sako

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[Clusters/Particles/Nanostructures]

13:00-14:50 1P024 Reactions of copper cluster cations and anions with NO: Enhancement of NO adsorption and reactivity in coadsorption with oxygen
(Genesis Res. Inst., Inc.1,Toyota Tech. Inst.2)*Shinichi Hirabayashi1,Masahiko Ichihashi2
13:00-14:50 1P025 Control of the Emission Behavior of a Single CdSe/ZnS Colloidal Quantum Dot by Plasmon Generated on an AFM Tip
(Graduate School of Science and Technology, Kwansei Gakuin Univ.)*Tomoki Tateishi,Sadahiro Masuo
13:00-14:50 1P026 Fabrication of Au core Ag-Pd alloy shell nanocrystals
(Institute for materials chemistry and engineering, Kyushu University)*Masashi Hattori,Masaharu Tsuji
13:00-14:50 1P027 The formation mechanism and synthesis of AgPt alloy nano prism by galvanic replacement reaction
(Industrial science and technology,Kinki Univ.1,Department of Applied Science for Electronics and Materials,Interdisciplinary Graduate School of Engineering Sciences,Kyusyu Univ.2,Institude for materials Chemistry and Engineering,Kyusyu Univ.3)*Mika Hamasaki1,Atsuhiko Yazima2,Masashi Hattori3,Hirohumi Kawazumi1,Masaharu Tsuji3, 2
13:00-14:50 1P028 Visualization of SERS Hot Spots Using Super-resolution Optical Imaging
(Graduate School of Science and Technology, Kwansei Gakuin Univ.)*Taisuke Fukui,Sadahiro Masuo
13:00-14:50 1P029 In situ mass spectroscopy of CVD synthesis of CNT
(Graduate School of Engineering, Hiroshima Univ.)*Daisuke Nakahara,Shuhei Inoue,Yukihiko Matsumura
13:00-14:50 1P030 Development of the point contact viscoelastic imaging atomic force microscopy
(IMRAM, Tohoku Univ.)*Norihisa Hoshino,Tomoyuki Akutagawa
13:00-14:50 1P031 Structures of sodium fluoride nanocrystal ions studied by mobility spectrometry
(Faculty of Science, Tohoku Univ.1,Graduate School of Science, Tohoku Univ.2)Tohru Takahashi1,Kanako Konno2,Keijiro Ohshimo2,Naoki Kishimoto2,*Fuminori Misaizu2
13:00-14:50 1P032 Electronic structure calculation for hydrogen absorption properties of Palladium/Platinum clusters
(Graduate School of Humanities & Sciences, Ochanomizu Univ.)*Aya Matsuda,Hirotoshi Mori
13:00-14:50 1P033 Nano morphology control by defects of organic crystals
(College of Humanities and Sciences, Nihon University)*Ken Judai,Yoshikiyo Hatakeyama
13:00-14:50 1P034 Effect of core size on electrocatalytic activity of Au-Pt core-shell nanoparticles
(Graduate School of Advanced Integration Science, Chiba Univ.1,College of Humanities and Sciences, Nihon Univ.2)*Saki Hirose1,Yoshikiyo Hatakeyama2,Ken Judai2,Keiko Nishikawa1
13:00-14:50 1P035 Two-Step Dielectric Spin-Crossover in a Neutral Fe(III) Compound
(Interdisciplinary Graduate School of Engineering Sciences, Kyushu University1,Department of Chemistry, Texas A&M University2)*Zhao-Yang Li1, 2,Jing-Wei Dai1,Osamu Sato1,Kim Dunbar2
13:00-14:50 1P036 Spectroscopic studies on gold nanoclusters prepared by using benzenethiol bearing glucose
(Graduate school of Science and Engineering, Kagoshima University)*Ryutaro Aoki,Akiko Kaminaga,Hiroaki Okamura,Junichi Kurawaki
13:00-14:50 1P037 Generation and reactivity of NiCr clusters
(The University of Tokyo)*Michał Piotr Kwiatkowski,Ken Miyajima,Fumitaka Mafune
13:00-14:50 1P038 Small angle X-ray scattering and surface-enhanced Raman scattering measurements of liquid-crystal-capped gold nanorods aligned by an external electric field
(Aichi Univ. of Edu.1,Grad. Sch. of Adv. Integ. Sci. , Chiba Univ.2,Col. of Hum. and Sci. , Nihon Univ.3)*Erika Kochi1,Hiroyasu Hotta1,Takeshi Morita2,Yoshikiyo Hatakeyama3,Keiko Nishikawa2,Kazuyuki Hino1
13:00-14:50 1P039 Electronic conductivity of aromatic hydrocarbons can be affected by adsorbing triplet oxygen molecule
(School of Science, Osaka University)*Keiji Kinoshita,Takashi Kawakami,Shohei Yoshimura,Yasutaka Kitagawa,Shusuke Yamanaka,Mitsutaka Okumura
13:00-14:50 1P040 Precise and systematic synthesis of metal clusters protected by two kinds of thiolate ligands
(Graduate School of Chemical Science and Technology, Tokyo University of Science)*Yoshiki Niihori,Miku Matsuzaki,Yuichi Negishi
13:00-14:50 1P041 Elucidation of magic number and origin of selenolate protected gold clusters
(Tokyo University of Science1,The University of Tokyo2,Institute for Molecular Science3)*Wataru Kurashige1,Seiji Yamazoe2,Keita Kanehira1,Masaki Yamaguchi1,Katsuyuki Nobusada3,Tatsuya Tsukuda2,Yuichi Negishi1
13:00-14:50 1P042 Synthesis, Electronical Structure, and Physical Property of Chalcogenate Protected Au25 Cluster
(Tokyo University of Science)*Masaki Yamaguchi,Wataru Kurashige,Yuichi Negishi

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[Solid phase]

13:00-14:50 1P043 Low-wavenumber Raman microspectroscopy with volume grating notch filters
(Department of Chemistry, Gakushuin Univ.)*Mitsuhiro Sato,Koichi Iwata
13:00-14:50 1P044 Matrix isolation study of the photochemical reaction of ethylene with hydrogen peroxide
(Iwate Univ.)*Yuuki Sasaki,Hitoshi Yashiro,Eiichi Suzuki
13:00-14:50 1P045 Vibrational spectra of methyl isocyanate-hydroxylamine complex in a low-temperature matrix
(Iwate Univ.)*Eiichi Suzuki,Shinnya Kikuchi,Hitoshi Yashiro
13:00-14:50 1P046 Printing electronics and electronic properties of organic-inorganic hybrid perovskites
(Faculty of Science, Hokkaido Univ.1,Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.2,JST-CREST3)*Hiroyuki HASEGAWA1, 3,Tsuyoshi OSAKI2,Giancarlo Lorena2,Yukihiro TAKAHASHI1, 2, 3,Jun HARADA1, 2, 3,Tamotsu INABE1, 2, 3
13:00-14:50 1P047 Pai-d interaction and magnetoresistance effect in the partially oxidized salt of axially ligated Cr-phthalocyanine
(Graduate School of Chemistry Sciences and Engneering, Hokkaido Univ.1,Graduate School of Science, Hokkaido Univ.2,JST-CREST3,Graduate School of Science, Osaka Univ.4)*YUSUKE TAKITA1,Yukihiro Takahashi1, 2, 3,Hiroyuki Hasagawa2, 3,jun Harada1, 2, 3,Tamotsu Inabe1, 2, 3,Akinori Kanda4,Noriaki Hanasaki4
13:00-14:50 1P048 Construction of molecular conductors composed of axially substituted cobalt tetrabenzoporphyrin
(Graduate School of Science Technology, Kumamoto Univ.)*Yutaro Kozaki,Masaki Matsuda
13:00-14:50 1P049 Development of a novel single crystal preparation method for molecular conductors: Crystal growth by photoirradiation
(Graduate School of Science and Technology, Kumamoto Univ.1,Tohoku Univ.2,Hokkaido Univ.3)*Miki Nishi1,Shoko Koga1,Mika Fujishima1,Masaki Matsuda1,Norihisa Hoshino2,Tomoyuki Akutagawa2,Hiroyuki Hasegawa3
13:00-14:50 1P050 Electron-nuclear spin state of a molecular spin qubit model as studied by single crystal ELDOR spectroscopy
(Graduate School of Science, Osaka City Univ.1,Graduate School of Science, Osaka Univ.2,Graduate School of Engineering Science, Osaka Univ.3,FIRST4)*Ayaka Tanaka1,Kazunobu Sato1, 4,Tomohiro Yoshino1,Shinsuke Nishida1, 4,Shigeaki Nakazawa1, 4,Robabeh Rahimi1,Kazuo Toyota1, 4,Daisuke Shiomi1, 4,Yasushi Morita2, 4,Masahiro Kitagawa3, 4,Takeji Takui1, 4
13:00-14:50 1P051 Sensitivity improvement of time-resolved ESR apparatus for molecular device measurement (2)
(Graduate School of Science. Osaka City University)Takafumi Matsumoto,Atsushi Tashiro,*Yoshio Teki
13:00-14:50 1P052 Theoretical calculations of zero-field splitting parameter D for single molecular magnets
(Graduate School of Science, Osaka Univ.)*Takashi Kawakami,Keiji Kinoshita,Shohei Yoshimura,Yasutaka Kitagawa,Shusuke Yamanaka,Kizashi Yamaguchi,Mitsutaka Okumura
13:00-14:50 1P053 Femtosecond transient absorption imaging of diarylethene derivatives in crystalline phase
(Graduate School of Engineering Science, Osaka Univ.1,JST/PRESTO2,Graduate School of Engineering ,Osaka City Univ.3)*Akira Jinno1,Tetsuro Katayama2, 1,Seiya Kobatake3,Hiroshi Miyasaka1
13:00-14:50 1P054 Chromism of diarylethene PFCP generated by shear stress and light
(Tokyo Univ. of Sci, Yamaguchi1,Tokyo Univ. of Sci, Yamaguchi2,Toyota Phys. Chem. Res. Inst.3,Muroran Inst. Tech.4)*Takeshi Inoue1,Makoto Inokuchi2,Kyuya Yakushi3,Ichimin Shirotani4
13:00-14:50 1P055 Fluorescence emission control of ESIPT dyes with extended π-system
(Chitose Institute of Science and Technology1,IMRAS, Tohoku Univ.2)*Ken-ichi Sakai1,Takaaki Ishikawa1,Chiori Ikeda1,Takemitsu Kikuchi2,Tomoyuki Akutagawa2
13:00-14:50 1P056 Valence tautomerism in a cobalt complex investigated by solid-state high-resolution 2H MAS-NMR
(Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1,School of Science, Hokkaido Univ.2,Graduate School of Science, Hokkaido Univ.3)*Shino Sato1,Kyohei Kaneda2,Goro Maruta3,Sadamu Takeda3
13:00-14:50 1P057 Design of organic ionic crystals for ferroelectrics : Studies on crystal structures and phase transitions
(Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1,Faculty of Science, Hokkaido Univ.2)*Takafumi Shimojou1,Jun HARADA1, 2,Yukihiro TAKAHASHI1, 2,Tamotsu INABE1, 2
13:00-14:50 1P058 Structures and dielectric behavior of charge transfer crystals of polar molecules
(Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1,Faculty of Science, Hokkaido Univ.2)*Shota SATO1,Jun HARADA1, 2,Yukihiro TAKAHASHI1, 2,Tamotsu INABE1, 2
13:00-14:50 1P059 Crystal structure and physical properties of (m-halogenoanilinium+)(dibenzo[18]crown-6)[Ni(dmit)2]-
(Graduate School of Environmental Science, Hokkaido University1,RIES, Hokkaido University2,IMRAM, Tohoku University3)*Shota Nakagawa1,Kazuya Kubo1, 2,Shin-ichiro Noro1, 2,Tomoyuki Akutagawa3,Takayoshi Nakamura1, 2
13:00-14:50 1P060 Structures of complexes: carbazole-TCNB and 9-methylcarbazole-TCNB
(Graduate school of systems engineering, Wakayama Univ.1,Faculty of systems engineering, Wakayama Univ.2)*Yuki Hayashi1,Hideo Yamakado2

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[Surface/Interface]

13:00-14:50 1P061 Formation processes of hydrogen atoms from VUV photodissociation of water ice at low temperatures
(Faculty of Engineering, Kyoto University1,Graduate School of Engineering, Kyoto University2)Motoki Yamazaki1,Masanori Okumura2,*Akihiro Yabushita2
13:00-14:50 1P062 Atomic Structure and Local Valence Electronic States of Clean Si(110)-16×2 surface by using Photoelectron Auger-electron coincidence spectroscopy
(Faculty of Science, Ehime University1,Institute of Materials Structure Science, High Energy Accelerator Research Organization2,The Graduate Uniersity for Advance Studies3)*Takuhiro Kakiuchi1,Yuya Yoshizaki1,Hiroyuki Kubota1,Yuki Sato1,Kazuhiko Mase2, 3
13:00-14:50 1P063 Measuring themopower of Au-BDT-Au molecular junction
(ISIR, Osaka Univ.)*Takanori Morikawa,Akihide Arima,Makusu Tsutsui,Masateru Taniguchi
13:00-14:50 1P064 Crystal growth of the charge transfer complex on the surface of the organic semiconductor crystal
(Graduate school of Chemical Sciences and Engineering, Hokkaido Univ.1,Graduate school of Science, Hokkaido Univ.2,JST-CREST3)*Yuki Nakajima1,Yukihiro Takahashi2, 3,Jun Harada2,Tamotsu Inabe2, 3
13:00-14:50 1P065 Detection of Local Magnetic Field in Light-Induced Charge-Separation Processes at Donor / Acceptor Interfaces
(Graduate School of Science, Nagoya Univ.1,Research Center for Materials Science2)*Kiyoshi Suzuki1,Michio M. MATSUSHITA1,Kunio Awaga1, 2
13:00-14:50 1P066 [canceled] Theoretical studies on cathode products in metal-air batteries
(Dept. of Chemical System Eng. The Univ. of Tokyo)*Kenta Tsubakiyama,Hiroshi Ushiyama,Koichi Yamashita
13:00-14:50 1P067 Single-molecule spectroscopy of anthracene derivative and its supramolecular capsulplex: Reduced heterogeneity in intersystem crossing, and enhanced photostability
(Graduate School of Science,Shizuoka Univ.)*Koji Higashi,Yohei Hirumi,Kenji Kobayashi,Masaaki Mitsui
13:00-14:50 1P068 Effect of organic compounds to mass accommodation reaction in sulfuric acid aerosol surface
(Graduate School of Science, Tohoku Univ.)*Suguru Sakaguchi,Akihiro Morita
13:00-14:50 1P069 Towards Heterodyne-Detected Sum-Frequency Generation from Buried Glass-Water Interface
(RIKEN)*Anton Myalitsin,Satoshi Nihonyanagi,Shoichi Yamaguchi,Tahei Tahara
13:00-14:50 1P070 Comprehensive calculation of sum frequency generation spectroscopy including the bulk contribution from electric quadrupole
(Graduate School of Science, Tohoku Univ.)*Hiromi Sawai,Kazuya Shiratori,Tatsuya Ishiyama,Akihiro Morita

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[Liquid phase]

13:00-14:50 1P071 Theoretical study of liquid ethanol by x-ray emission spectroscopy
(Institute for Sustainable Sciences and Development, Hiroshima Univ.1,Stockholm University2)*Osamu Takahashi1,Lars Pettersson2
13:00-14:50 1P072 Development of wavelength-tunable ultrafast degenerate four-wave-mixing measurement system and observation of ultrafast electron transfer
(Grad. Scho. Engi. Scie.1,Kyokugen2,JST PRESTO3)*Yusuke Yoneda1,Shohei Nanbu1,Hiroki Tsumori1,Eisuke Takeuchi1,Masayasu Muramatsu1,Yutaka Nagasawa1, 2, 3,Hiroshi Miyasaka1, 2
13:00-14:50 1P073 Photoactivity study of Ruthenium (II) aqua Complexes in Water by Time-Resolved Infrared Spectroscopy
(Tokyo Tech.1,Niigata Univ.2,JST3)*Sei-ichi Tanaka1,Masayuki Yagi2,Ken Onda1, 3,Shin-ya Koshihara1
13:00-14:50 1P074 Photophysical study on the absolute photoluminescence quantum yield using an integrating sphere
(Gunma University1,Hamamatsu Photonics K.K.2)*Hiromi Suzuki1,Kengo Suzuki2,Shigeru Eura2,Toshitada Yoshihara1,Seiji Tobita1
13:00-14:50 1P075 Synthesis and properties of ionic liquids containing sandwich-type ruthenium complexes
(Graduate School of Science, Kobe Univ.)*Aina Komurasaki,Tomoyuki Mochida
13:00-14:50 1P076 Spectropic Observation of Tautomerism of 2-Amino-1,3-diazaazulene and 2-Mercapt-1,3-diazaazulene
(Nihon Univ1,Nuhon Univ2,Nihon Univ3)*Takatoshi Sato1,Shouhei Akiba2,Katsuhiko Okuyama3
13:00-14:50 1P077 Impact of the donor/acceptor strengths of push-pull type chromophore on the two-photon absorption transition intensity
(AIST1,Graduate School of Science and Technology, Kwansei Gakuin Univ.2,INSA de Lyon3,ENS de Lyon4)*Kazuya Tokunaga1, 2,Kenji Kamada1, 2,Koji Ohta1,Juilen Massin3,Redon Sebastien3, 4,Stephane Chambert4,Yann Bretonniere3,Chantal Andraud3
13:00-14:50 1P078 Vibrational analysis of cyclopentane-1,3-diyl singlet biradical species with carbonyl groups
(Graduate School of Science, Hiroshima Univ.1,Graduate School of Pure and Applied Sciences, Tsukuba Univ.2)*Shin Seyama1,Mishima Megumi1,Abe Manabu1,Ishibashi Taka-aki2
13:00-14:50 1P079 New pi-bridged TTF dimer TTF-CH=CH-CH=CH-CH=CH-TTF: Solvent polarity effects on the UV-vis absorption and fluorescence emission spectra
(AIST, ESPRIT1,AIST, NRI2)*Yoriko Sonoda1,Yukihiro Shimoi2,Masatoshi Kanesato1
13:00-14:50 1P080 Femtosecond time-resolved near-infrared spectra of poly(9-vinylcarbazole) photoirradiated in solution
(Department of Chemistry, Gakushuin University)*Masanori Shinohara,Tomohisa Takaya,Koichi Iwata
13:00-14:50 1P081 Ultrafast Intramolecular Charge Separation Process of 10-cyano-9,9'-bianthryl in polar solvents.
(Graduate School of Engineering Science, Osaka Univ.)*Eisuke Takeuchi,Masayasu Muramatsu,Syoji Ito,Yutaka Nagasawa,Hiroshi Miyasaka
13:00-14:50 1P082 Observation of periodic structures during laser-induced phase separation by using single-shot structures illumination microscopy
(Graduate School of Science, Tohoku Univ.1,WPI-AIMR, Tohoku Univ.2)*Shuichi Toyouchi1,Shinji Kajimoto1,Masatoshi Toda1,Yohji Akama1,Toshihiro Kawakatsu1,Motoko Kotani1, 2,Hiroshi Fukumura1

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[Biomolecules]

13:00-14:50 1P083 Femtosecond Kerr-gate Fluorescence measurement of Anabaena sensory rhodopsin.
(Mol. Spec. Lab., RIKEN1,Titech2)*Shinya Tahara1, 2,Zhengrong Wei1,Satoshi Takeuchi1,Hiroyuki Ohtani2,Tahei Tahara1
13:00-14:50 1P084 A theoretical study on early intermediates of bovine rhodopsin by QM/MM RWFE method
(Graduate School of Science, Kyoto Univ.)*Motoshi Kamiya,Shigehiko Hayashi
13:00-14:50 1P085 A theoretical study on color variants of bacteriorhodopsin
(Graduate School of Science, Kyoto Univ.1,Graduate School of Science, Nagoya Univ.2)*Seiya Sugo1,Motoshi Kamiya1,Yuki Sudo2,Shigehiko Hayashi1
13:00-14:50 1P086 Transient absorption spectroscopy of Sensory Rhodopsin II by visible 5-fs laser pulses
(Graduate School of Science, Kyoto Univ.1,Graduate School of Science, Nagoya Univ.2,RIKEN3)*Yuya Watanabe1,Yuki Sudo2,Toshinori Suzuki1, 3,Shunsuke Adachi1
13:00-14:50 1P087 A color determining amino acid in proteorhodopsin
(Nagoya Inst. Tech.)Yuya Ozaki,Takayoshi Kawashima,Rei Yoshizumi,*Hideki Kandori
13:00-14:50 1P088 Infrared and raman spectroscopy of the diastereomer of alanylalanine
(School of Science, Kitasato University)*Yasutoshi Kasahara,Kento Tomioka,Haruki Ishikawa
13:00-14:50 1P089 Solvated Secondary Structure of Poly-L-Alanine Studied by Quantum Chemical Computation of Raman Optical Activity Spectra
(Graduate School of Science and Technology, Kwansei Gakuin Univ.1,Graduate School of Science, Osaka Univ.2)*Tatsuya Furukawa1,Shigeki Yamamoto2,Yukihiro Ozaki1
13:00-14:50 1P090 Theoretical study on the pKa estimation of molecules with plural protonation sites
(Graduate School of Engineering Science, Osaka Univ.1,RIKEN, Advanced Institute for Computational Science2,CREST3)*Takeshi Baba1,Toru Matsui2,Masayoshi Nakano1,yasuteru Shigeta1, 3
13:00-14:50 1P091 Theoretical Study of a π-stacking Interaction Effect to the Orientation of His64 of Carbonic Anhydrase
(Kanazawa University1,Japan Advanced Institute of Science and Technology2)*Muhamad Koyimatu1,Hideto Shimahara2,Kimikazu Sugimori1,Tetsuya Sugimori1,Hirosaki Saito1,Kazutomo Kawaguchi1,Hidemi Nagao1
13:00-14:50 1P092 Theoretical studies on effects of protein--protein interactions on azurin complex stability by coarse-grained model
(Institute of Science and Engineering, Kanazawa University1,School of Life Sciences, Tokyo University of Pharmacy and Life Sciences2)*Micke Rusmerryani1,Masako Takasu2,Kazutomo Kawaguchi1,Hiroaki Saito1,Hidemi Nagao1

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[Theory/Calculation]

13:00-14:50 1P093 A theoretical study of geometry and electronic structure of η4-tetrasilacyclobutadiene complexes of Co(I) and Ru(II)
(FIFC, Kyoto Univ.)*Nozomi Takagi,Shigeyoshi Sakaki
13:00-14:50 1P094 Theoretical Study of Mononuclear Nickel(I), Nickel(0), Copper(I), and Cobalt(I) Dioxygen Complexes: New Insight into Differences and Similarities in Geometry and Bonding Nature
(Fukui Institute for Fundamental Chemistry, Kyoto University)*Yue Chen,Shigeyoshi Sakaki
13:00-14:50 1P095 The coordination geometry and interaction of small molecule with trigonal bipyramidal Co and Fe complexes
(FIFC, Kyoto Univ)*Shinya Tsukamoto,Shigeyoshi Sakaki
13:00-14:50 1P096 Reaction between CO2 and Zinc Hydride: Interesting Theoretical Insights
(Fukui Institute for Fundamental Chemistry, Kyoto University)*Milind Deshmukh,Shigeyoshi Sakaki
13:00-14:50 1P097 CO2 Insertion into Ni(I)-Alkyl and Ni(II)-Alkyl Bonds. Interesting Differences
(Fukui Institute for Fundamental Chemistry, Kyoto Unviersity)*Fareed Bhasha Sayyed,Sakaki Shigeyoshi
13:00-14:50 1P098 Oxidative Addition of Anhydride to Nickel(0) Species: Reactivity and Regioselectivity
(Fukui Institute for Fundamental Chemistry, Kyoto Univ.)*Wei Guan,Shinichi Yamabe,Shigeyoshi Sakaki
13:00-14:50 1P099 Localized vs. delocalized ground and excited states of square planar metal-salen complexes: theoretical study of solvation effects
(Fukui Institute for Fundamental Chemistry, Kyoto Univ.)*Shinji Aono,Masayuki Nakagaki,Shigeyoshi Sakaki
13:00-14:50 1P100 A theoretical study of the reactions of (methyl)(DMAP)tungsten complex with trimethylsilane and dimethoxymetylsilane
(Graduate School of Engineering,Gunma University)*Yoshitomo Ishiguro,Takako Kudo
13:00-14:50 1P101 A Theoretical Study of the Valence Isomers of SinC8-nH8(n=0~8)
(Graduate School of Engineering, Gunma Univ.)*Atsumi Mesuda,takako kudo
13:00-14:50 1P102 Theoretical study of chemical bond using lagrange surface in polyatomic molecules
(Graduate School of Technology, Kyoto Univ.)*Hiroo Nozaki,Kaxuhide Ichikawa,Akitomo Tachibana
13:00-14:50 1P103 Efficient method for the calculation of photon interaction in numerical simulation based on Rigged QED
(Department of Micro Engineering, Kyoto University)*Sojiro Takada,Masato Senami,Akitomo Tachibana
13:00-14:50 1P104 Theoretical study of ionic nature of chemical bonding by electronic stress tensor density and kinetic energy density
(Department of Micro Engineering, Kyoto University)*Yosuke Fujii,Hiroo Nozaki,Kazuhide Ichikawa,Akitomo Tachibana
13:00-14:50 1P105 Time evolution simulation of Rigged QED in Schwarzschild spacetime
(Department of Micro Engineering, Kyoto Univ.)*Hidenori Miyamoto,Masahiro Fukuda,Kazuhide Ichikawa,Akitomo Tachibana
13:00-14:50 1P106 Theoretical study of time evolution of local quantities in Rigged QED
(Graduate school of Engineering, Kyoto Univ.)*Masahiro Fukuda,Kazuhide Ichikawa,Akitomo Tachibana
13:00-14:50 1P107 Efficient calculations of thermalization process in Primary Rigged QED simulation
(Departmant of Micro Engineering, Kyoto University)*Yuuki Tanaka,Soujirou Takada,Masato Senami,Akitomo Tachibana
13:00-14:50 1P108 Spin torque by electron electric dipole moment
(Graduate School of Engineering,Kyoto Univ.)*Yoji Ogiso,Akitomo Tachibana,Masato Senami,Masahiro Fukuda
13:00-14:50 1P109 Theoretical study on the diradical character dependence of the second-order nonlinear optical properties of asymmetric open-shell singlet molecules
(Graduate School of Engineering Science)*Masayoshi Nakano
13:00-14:50 1P110 Theoretical study on the electronic structures and optical response properties of open-shell chemical species involving cyclopentane-1,3-diradical structure.
(Graduate School of Chemical Engineering, Osaka Univ.1,Graduate School of Science, Hiroshima Univ.2)*Yusuke Murata1,Ryohei Kishi1,Keisuke Morita1,Hideki Uenaka1,Manabu Abe2,Masayoshi Nakano1
13:00-14:50 1P111 Theoretical study on the diradical character and third-order nonlinear optical properties of 4-membered ring compounds involving heavy main group elements
(Graduate School of Engineering Science, Osaka Univ.)*Hiroshi Matsui,Kotaro Fukuda,Yuta Hirosaki,Ryohei Kishi,Masayoshi Nakano
13:00-14:50 1P112 Theoretical study on the absorption properties of organic diradical ligands in rare earth complexes
(Graduate School of Engineering Science, Osaka University1,Graduate School of Science, Osaka City University2,College of Science and Engineering, Aoyama Gakuin University3)*Ryota Nakamura1,Yasuteru Shigeta1,Katsuki Okuno1,Ryohei Kishi1,Shuichi Suzuki2,Masatoshi Kozaki2,Keiji Okada2,Miki Hasegawa3,Masayoshi Nakano1
13:00-14:50 1P113 Theoretical study on the structure-property relationship of the acid dissociation constants of heterocyclic compounds
(Graduate School of Engineering Scinece, Osaka Univ.)*Hiroyuki Ando,Takeshi Baba,Katsuki Okuno,Yasuteru Shigeta,Masayoshi Nakano
13:00-14:50 1P114 Searching for isomerization pathways of Si6H6 and C6H6 by using GRRM - SCC-DFTB method
(Graduate School of Systems Engineering, Wakayama Univ.1,Faculty of Systems Engineering, Wakayama Univ.2,Institute for Quantum Chemical Exploration; Grad. Sch. Sci. Tohoku Univ.3)*Hiroaki Tokoyama1,Hideo Yamakado2,Koichi Ohno3
13:00-14:50 1P115 Global reaction route mapping of phosphorus compounds by the SHS method
(Faculty of Systems Engineering, Wakayama Univ.1,Graduate School of Systems Engineering, Wakayama Univ.2,Institute for Quantum Chemical Exploration3,Grad. Sch. Sci. Tohoku Univ.4)*Naoya Katsuno2,Yoshitomo Kodaya1,Hideo Yamakado1,Koichi Ohno3, 4
13:00-14:50 1P116 Searching for structures of low-dimensional materials by the Scaled Hypersphere Search method
(Graduate 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)*Yu Sawada1,Hideo Yamakado2,Koichi Ohno3, 4
13:00-14:50 1P117 Theoretical-Data Chemistry: Data Repository and Applications of Chemical Reaction Path Information Obtained from Scaled Hypersphere Search
(National Institute of Informatics1,Software Research Associates, Inc.2,Institute for Quantum Chemical Exploration3)*Hiroko Satoh1,Borini Stefano1,Oda Tomohiro2,Kumiyo Nakakoji2,Koichi Ohno3
13:00-14:50 1P118 Theoretical study on hydration energy of hexopyranose anomer in aqueous solution
(Graduate School of Science, Hiroshima Univ.1,QuLiS, Hiroshima Univ.2)*Sakiko Idei1, 2,Misako Aida1, 2
13:00-14:50 1P119 A theoretical study on the interaction between TMAO and water molecules
(Graduate School of Science, Hiroshima Univ.1,The Center for Quantum Life Science, Hiroshima Univ.2)*Yudai Watanabe1, 2,Hideo Doi1, 2,Misako Aida1, 2
13:00-14:50 1P120 Theoretical study on the [2+2+2] reaction mechanism of cationic and excited acetylene trimer
(Gifu University1,Gifu University2)*Keita Nakada1,Taro Udagawa2,Shogo Sakai2
13:00-14:50 1P121 Quantum Chemical Study of B(C6F5)3-Catalyzed Hydrosilylation of Carbonyl Compounds
(Hoshi Univ.)*Ken Sakata
13:00-14:50 1P122 Calculation of x-ray absorption spectra of excited triplet state
(Graduate School of Science, HIroshima Univ.)*Sena Nagashima,Osamu Tahahashi,Kazufumi Yamamoto,Atsunari Hiraya
13:00-14:50 1P123 Theoretical study of the excited state and the electronic structure of the Diels-Alder reaction product of C60 and acenes
(Graduate School of Engineering, Kitakyu Univ)*Kawakami Yuma,Atsushi Nogami
13:00-14:50 1P124 Theoretical study on the reaction mechanism of the amide bond cleavage
(Faculty of Science, Kanagawa Univ.)*Chikako Ueta,Toshiaki Matsubara
13:00-14:50 1P125 Three types of sigma-bond activation of n-C3H8 on coordinatively unsaturated tungsten center (W(CO)5)
(Department of Chemistry and Materials Technology, Kyoto Institute of Technology)*binti Che Yob Nur Syuhada,Yo-ichi Ishikawa
13:00-14:50 1P126 Ab initio calculations of the formic acid dimer in the electronic states with high accuracy
(Graduate School of Engineering, NITech)*Touki Chin,Norihiro Shida
13:00-14:50 1P127 Theoretical study of multiple proton transfer of the 7-azaindole -H2O complex in the S1 state
(Graduate School of Engineering, NITech)*Yuki Fujisawa,Norihiro Shida
13:00-14:50 1P128 Electronic excited states and electronic spectra of biphenyl: a study using many-body wavefunction methods and density functional theory
(Institute for Molecular Science1,Research Center for Computational Science2,Elements Strategy Initiative for Catalysts and Batteries (ESICB), Kyoto University3)*Ryoichi Fukuda1, 2, 3,Masahiro Ehara2, 1, 3
13:00-14:50 1P129 Molecular iodine for neutrino mass spectroscopy
(Institute for Molecular Science1,Research Core for Extreme Quantum World, Okayama Univ.2,Graduate School of Natural Science and Technology, Okayama Univ.3,Faculty of Science, Okayama Univ.4)*Motomichi TASHIRO1,masahiro ehara1,susumu kuma2,yuki miyamoto3,noboru sasao2,satoshi uetake4,motohiko yoshimura4
13:00-14:50 1P130 An extension of locally diabatic representation by introducing molecular orbital extrapolation and its application to configuration state function based mixed quantum classical method
(School of Engineering, Univ. of Tokyo)*Tomotaka Kunisada,Hiroshi Ushiyama,Koichi Yamashita
13:00-14:50 1P131 Theoretical Study on Intermolecular Interactions in Complexes of Cyclodextrins with Bile Acids: DFT and ab initio Fragment Molecular Orbital Calculations
(Department of Chemistry and Biochemistry, Graduate School of Humanities and Sciences, Ochanomizu Univ.1,Department of Chemistry, Faculty of Science, Ochanomizu Univ.2)*Lan Yao1,Yukie Mori2,Keiko Takano1
13:00-14:50 1P132 Theoretical study on the redox process of the tri-iron complexes containing 1,1’-ferrocenedichalcogenato ligand
(Graduate School of Humanities and Sciences, Ochanomizu Univ.1,Liberal Arts Education, Saitama Medical Univ.2,Guraduate School of Science, Osaka City Univ.3)*Sayuri Fujiki1,Noriko Tsuchida2,Masaki Ito3,Masumi Itazaki3,Hiroshi Nakazawa3,Keiko Takano1
13:00-14:50 1P133 Interaction analysis on adrenergic α2 receptor and ligand complexes
(Faculty of Pharmacy, Yasuda Women's University)*Mami Gannai,Yasuyo Shimodo,Akira Shibata
13:00-14:50 1P134 Theoretical studies on redox potential of blue copper proteins by MD and QM/MM calculations
(Graduate School of Natural Science and Technology, Kanazawa University1,Research Center for Higher Education, Kanazawa University2)*Masashi Iwayama1,Hiroaki Saito1,Kimikazu Sugimori2,Kazutomo Kawaguchi1,Hidemi Nagao1
13:00-14:50 1P135 Quantum chemical calculations of water binded sphingomyelin lipid molecules by using a pin holdar model
(Research Center for Higher Education, Kanazawa Univ.1,Faculty of Social Work, Kinjo Univ.2)*Kimikazu Sugimori1,Hiroyuki Kawabe2
13:00-14:50 1P136 O2 binding mechanism in hemocyanin: a qm/mm study
(Max-Planck-Institut für Kohlenforschung)*Toru Saito,Walter Thiel
13:00-14:50 1P137 A theoretical study on the fluorescent spectrum of enhanced green fluorescent protein
(Graduate School of Science, Kyoto Univ.1,Institute for Molecular Science2)*Yoshihiro Uchida1,Masahiro Higashi2,Shigehiko Hayashi1
13:00-14:50 1P138 Theoretical study on the gtp hydrolysis catalysis of the ras-gap
(Graduate School of Science, Kyoto Univ.1,Faculty of Science, University of the Ryukyus2)*Keiei Kumon1,Masahiro Higashi2,Shigehiko Hayashi1