Poster Sessions
Wednesday, September 25 (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.
[Gas phase]
| 13:00-14:50 | 2P001 |
Zeeman effect of 0-0 band of NO3 B-X transition （Molecular Photoscience Research Center, Kobe Univ.1，Faculty of Science, Kobe Univ.2，Graduate School of Science, Kobe Univ.3，Faculty of Information Science, Hiroshima City Univ.4，The Graduate Univ. for Advanced Studies5）*Shunji Kasahara1，Wataru Kashihara2，Kohei Tada3，Kanon Teramoto2，Tuyoshi Takashino2，Takashi Ishiwata4，Eizi Hirota5 |
| 13:00-14:50 | 2P002 |
High-resolution laser spectroscopy of vibronic bands of Naphthalene S1-S0 transition （Graduate School of Science, Kobe Univ.1，Molecular Photoscience Research Center, Kobe Univ.2）*Takumi Nakano1，Ryo Yamamoto1，Shunji Kasahara2 |
| 13:00-14:50 | 2P003 |
High-resolution laser spectroscopy of the S1 ← S0 transition of chloronaphthalene （Graduate School of Science, Kobe Univ.1，Molecular Photoscience Research Center, Kobe Univ.2）*Ryo Yamamoto1，Kenichiro Kanzawa1，Takumi Nakano1，Shunji Kasahara2 |
| 13:00-14:50 | 2P004 |
High-resolution infrared emission spectrum of DCl and the non-Born-Oppenheimer analysis （Graduate School of Science, Josai Univ.）*Yukihiro Sakamoto，Shunsuke Katsuie，Koui Horiai，Hiromichi Uehara |
| 13:00-14:50 | 2P005 |
High-resolution infrared emission spectrum of AlD and the non-Born-Oppenheimer analysis （Graduate School of Science, Josai Univ.）*Shinka Yabe，Koui Horiai，Hiromichi Uehara |
| 13:00-14:50 | 2P006 |
Gas-phase spectroscopy of hydrated 5-hydroxy indole: fluctuation of hydration structure （Kyushu University）*Kenji Sakota，Yuuki Kouno，Hiroshi Sekiya |
| 13:00-14:50 | 2P007 |
Gas phase spectroscopy of tripeptide GWP by laser desorption supersonic jet technique （Chem.Res.Lab.,Tokyo Tech.）*Takuma Aoki，Woon Yong Sohn，Shun-ichi Ishiuchi，Masaaki Fujii |
| 13:00-14:50 | 2P008 |
Supersonic jet spectroscopy of m-tyramine synthesized by in-situ thermal decomposition method - propensity rule for conformations of catecholamine neurotransmitter analogs （Chemical Resources Laboratory, Tokyo Tech.1，School of Science, Kitasato Univ.2）*Shun-ichi Ishiuchi1，Taichi Warashina2，Haruki Ishikawa2，Masaaki Fujii1 |
| 13:00-14:50 | 2P009 |
Laser desorption supersonic jet spectroscopy of nucleobase by using photo-ionization of naphthyl group – observation of keto form （Chemical Resources Lab., Tokyo Tech.1，Graduate School of Biosci. and Biotech., Tokyo Tech.2，Graduate School of Nanobiosci., Yokohama City Univ.3）*Hiroya Asami1，Yoshiaki Masaki2，Shun-ichi Ishiuchi1，Hiroyuki Saigusa3，Mitsuo Sekine2，Masaaki Fujii1 |
| 13:00-14:50 | 2P010 |
Electronic spectra of jet-cooled poly-phenylethynyl compounds ―1,4-diethynylbenzene and 14-bis(phenylethynyl)benzene― （College Sch. of Eng. NIhon Univ.1，College of Eng. Nhon Univ.2）*Takaki Itakura1，Katsuhiko Okuyama2 |
| 13:00-14:50 | 2P011 |
Comparison of solvation process between 2-Aminopyridine and Aminopyrazine clusters （Graduate School of Science, Fukuoka Univ.）*Yuji Goto，Yuji Yamada，Yoshinori Nibu |
| 13:00-14:50 | 2P012 |
Conformational influence on CH stretching vibrations of benzyl methyl eth （Graduate School of Science, Fukuoka Univ.）*Yuji Yamada，Hiroko Sasaki，Satomi Koreki，Mai Kano，Yuji Goto，Shizuka Okajima，Yoshinori Nibu |
| 13:00-14:50 | 2P013 |
Excess electron binding motif in negatively charged clusters of secondary amides studied by photoelectron spectroscopy （Graduate School of Science, Tohoku Univ.）*Takuto Shimamori，Asuka Fujii，Toshihiko Maeyama |
| 13:00-14:50 | 2P014 |
Analysis of vibrationally excited modes in the neutral ground state generated upon autodetachment of fluorenone anion （Graduate School of Science, Tohoku Univ.）*Toshihiko Maeyama，Asuka Fujii |
| 13:00-14:50 | 2P015 |
Extraction of electron-ion differential scattering cross sections from angle-resolved rescattering photoelectron spectra of C2H4 and C2H6 measured using IR laser pulses （IMRAM, Tohoku Univ.1，Texas A&M Univ.2，Univ. of Electro-communications3）*Yuta Ito1，Misaki Okunishi1，Kozo Shimada1，Robert Lucchese2，Toru Morishita3，Kiyoshi Ueda1 |
| 13:00-14:50 | 2P016 |
Wavelength dependence of rescattering electron spectra of CO2 molecule （IMRAM, Tohoku University1，IIT Hyderabad2，Tesas A&M Univ.3，Univ. of Electro-Communications)4）*Misaki Okunishi1，Vandana Sharma2，Yuta Itoh1，Robert Lucchese3，Toru Morishita4，Kiyoshi Ueda1 |
| 13:00-14:50 | 2P017 |
Anisotropic ionization of NO in few-cycle intense laser fields: Effects of \pi-\sigma electronic transition （Graduate School of Science, Nagoya Univ.1，The Open Univ. of Japan2，The Univ. of Electro-Communications3）*Tomoyuki Endo1，Mizuho Fushitani1，Akitaka Matsuda1，Tomokazu Yasuike2，Toru Morishita3，Akiyoshi Hishikawa1 |
| 13:00-14:50 | 2P018 |
Femtosecond laser ionization of molecular species produced in a pulsed dishcarge jet （Niigata Univ. Pharm.& Appl. Life Sciences1，Helsinki Univ.2）Tomoya Miyatake1，Masafumi Kobayashi1，Tatsuro Shirota1，Masashi Tsuge2，*Kennosuke Hoshina1 |
| 13:00-14:50 | 2P019 |
Ultrafast photoelectron spectroscopy of electro-nuclear wave packet in N2 Rydberg （Graduate School of Science, Nagoya Univ.1，INRS-EMT2）*Yuto Toida1，Mizuho Fushitani1，François Légaré2，Akiyoshi Hishikawa1 |
| 13:00-14:50 | 2P020 |
Angular momentum coupling in molecular Landau levels （Doshisha Univ.）*Yasuyuki Kimura |
| 13:00-14:50 | 2P021 |
Entropy effects on isomer distributions of Fe+(H2O)n （Faculty of Sciences, Kyushu Univ.1，Inst. for Molecular Science2）*Kazuhiko Ohashi1，Gun Yamamoto1，Jun Sasaki1，Ken Judai2，Nobuyuki Nishi2，Hiroshi Sekiya1 |
| 13:00-14:50 | 2P022 |
Ionization dynamics of three atomic molecules excited to O1s -> Rydberg states （University ofHyogo1，UVSOR2，Niigata University3，JASRI4）*Tatsuo Gejo1，Takeshi Ikegami1，Kenji Honma1，Eiji Shigemasa2，Yasumasa Hikosaka3，Yuusuke Tamenori4 |
| 13:00-14:50 | 2P023 |
Kinetics of the reaction of FeO radical with simple hydrocarbons （Dept. of Science, Japan Womens' Univ.）*Nami Yamakita，Fumika Imahori，Hanae Takada，Takashi Imajo |
| 13:00-14:50 | 2P024 |
Coincidence measurements of scattered ions and fragments in the Ar8+-COS collision （Dept. Chem., Tokyo Metropolitan Univ.1，Dept. Chem., Tokyo Metropolitan Univ.2，Dept. Phys., Univ. of Waterloo3）*Haruaki Tezuka1，Ayumi Fukutome2，Reza Karimi3，Jun Matsumoto1，Joseph Sanderson3，Haruo Shiromaru1 |
[Clusters/Particles/Nanostructures]
| 13:00-14:50 | 2P025 |
Photocurrent enhancement in organic photovoltaic devices with modified bulk heterojunction （The University of Hong Kong）Ping-Kuen Daniel Tsang，*Mei Yee Maggie Chan，Wing-Wah Vivian Yam |
| 13:00-14:50 | 2P026 |
Cyclometalated organoplatinum(II) complex for yellow and white organic light-emitting devices （The University of Hong Kong）*Shiu-Lun Larry Lai，Chi-Ming Che |
| 13:00-14:50 | 2P027 |
Photodissociation spectra of size-selected silver cations measured in a linear ion trap （Kyushu Univ.）*Tomonori Ito，Masashi Arakawa，Akira Terasaki |
| 13:00-14:50 | 2P028 |
Quantum chemical calculations on the structures of rare gas cycloalkane van der Waals complexes （Faculty of Science,Josai Univ.）*Kiyoshi Miyagawa，Toichi Konno，Yasushi Ozaki |
| 13:00-14:50 | 2P029 |
Infrared diode laser spectroscopy of rare gas－C16O18O （Faculty of Science, Josai Univ.）*Ken Shibuya，Toichi Konno，Yasushi Ozaki |
| 13:00-14:50 | 2P030 |
Frequencies and absorption intensities of NH stretching vibration of NH---π hydrogen-bonded pyrrole complexes. （Department of Biological and Chemical Systems Engineering, Kumamoto National College of Technology1，Josai Univ.2，The Open Univ. of Japan3，Kwansei-Gakuin Univ.4）*Yoshisuke Futami1，Yasushi Ozaki2，Yoshiaki Hamada3，Yukihiro Ozaki4 |
| 13:00-14:50 | 2P031 |
Exciton dynamics of silicon quantum dots –Femtosecond near-IR transient absorption spectroscopic study– （Graduate School of Science and Technology, Kwansei Gakuin University1，Graduate School of Science, University of Hyogo2）*Dong Chen1，Li Wang1，Hiroshi Yao2，Seiichi Sato2，Naoto Tamai1 |
| 13:00-14:50 | 2P032 |
Synthyesis of CdSe Nanoplatelets and their Exciton Dynamics （Kwansei Gakuin University1，Graduate School of Kwansei Gakuin2）*yuki usui1，Yuki Tomizawa2，Naoto Tamai2 |
| 13:00-14:50 | 2P033 |
Thermal stability and reactivity of manganese oxide clusters （Univ. Tokyo）*Kohei Koyama，Ken Miyajima，Fumitaka Mafune |
| 13:00-14:50 | 2P034 |
Structures of stable products in the reaction of aluminum cluster cations with oxygen and water molecules （Graduate school of Science, Kyushu Univ.）*Kei Kohara，Masashi Arakawa，Akira Terasaki |
| 13:00-14:50 | 2P035 |
Magic numbers of gold clusters stabilized by polyvinylpyrrolidone （Dept. of Chem., The Univ. of Tokyo）*Setsuka Arii，Satoru Muramatsu，Shinjiro Takano，Junichi Nishigaki，Seiji Yamazoe，Kiichirou Koyasu，Tatsuya Tsukuda |
| 13:00-14:50 | 2P036 |
Development of a novel pulsed valve for probing large molecules in vacuum chamber （University of Hyogo, Material Science）*Takahiro Tajiri，Kana Sakamoto，Tatsuo Gejo，Kenji Honma |
| 13:00-14:50 | 2P037 |
Preparation and characterization of polymer / thiophene protected silver nanoparticles （Graduate School of Science and Engineering, Kagoshima Univ.）*Haruna Ishibashi，Akiko Kaminaga，Junichi Kurawaki |
| 13:00-14:50 | 2P038 |
Imaging of surface plasmon modes in a silver hexagonal microplate （School of Advanced Science and Engineering, Waseda Univ.）*Hidetoshi Mizobata，Kohei Imura |
| 13:00-14:50 | 2P039 |
Ultra-sensitive absorption spectroscopy using a scanning near-field optical microscope （waseda university）*Yuki Tsutsumiuchi，Hidetoshi Mizobata，Kouhei Imura |
| 13:00-14:50 | 2P040 |
Optical properties of ultrathin Au nanowires （Dept. of Chem., The Univ. of Tokyo）*Ryo Takahata，Seiji Yamazoe，Kiichirou Koyasu，Tatsuya Tsukuda |
| 13:00-14:50 | 2P041 |
Syntheses and analyses of Pt nanoparticles on the cathode of organic molecules-based solar cells （Faculty of Science, Josai Univ.）*Ryo Furugori，Mutsumi Kawano，Koichiro Mitsuke，Motoko Akita |
| 13:00-14:50 | 2P042 |
Ionization of biologically active substances using Ag nanoparticles （Graduate school of Science and Technology, Tokyo Metropolitan University）*Tatsuya Fujino，Mengui Yang |
| 13:00-14:50 | 2P043 |
Near-field optical microscopy of tubular cyanine J-aggregates （Waseda Univ.）Yoshihiko Makita，*Kohei Imura |
[Solid phase]
| 13:00-14:50 | 2P044 |
Improvement of portable Raman imaging spectrometer using dimension-compressed imaging fiber for remote measurements （Grad. Sch. of Sci. & Eng., Saitama Univ.1，Col. of Sci. & Eng., Aoyama Gakuin Univ.2，S. T. Japan Inc.3）*Chihiro Igarashi1，Akira Sakamoto2，Koji Masutani3，Shukichi Ochiai3，Hisamitsu Higashiyama3 |
| 13:00-14:50 | 2P045 |
Polymorphs-selected electronic spectroscopy of N-(5-methylsalicylidene)aniline : Effects of differences in the crystal and molecular structures on the nonradiative processes （Graduate School of Science, Kyushu Univ1，Graduate School of Science Education, Hiroshima Univ2）*tomoya nakagawara1，Kazuki Furukawa1，Kiichi Amimoto2，Hiroshi Sekiya1 |
| 13:00-14:50 | 2P046 |
Fluorescence probe of a change in the environment with a solid/solid phase transition of acetonitrile （Kyushu Univ.1，Aichi Univ. of Edu.2，Chiba Inst. of Tech.3，Hokkaido Univ.4）*Kazuki Furukawa1，Kazuyuki Hino2，Norifumi Yamamoto3，Takakazu Nakabayashi4，Nobuhiro Ohta4，Hiroshi Sekiya1 |
| 13:00-14:50 | 2P047 |
Structure and properties of new perylene radical salts （Dept. Chem., Tokyo Metropolitan Univ.）*Sho Adnas Takahashi，Wataru Fujita，Takeshi Kodama，Koichi Kikuchi |
| 13:00-14:50 | 2P048 |
Carrier transport properties at the interface of organic crystals （Grad. School of Chem. Sci. and Eng., Hokkaido Univ.1，Faculty of Sci., Hokkaido Univ.2，JST-CREST3）*Katsuya Takayama1，Yuki Nakagawa1，Hiroyuki Hasegawa2, 3，Yukihiro Takahashi1, 2, 3，Jun Harada1, 2, 3，Tamotsu Inabe1, 2, 3 |
| 13:00-14:50 | 2P049 |
Structure and properties of halide salts of reduced pi-donor DODHT （Department of Chemistry, Ibaraki University1，Graduate School of Pure and Applied Scieces, University of Tsukuba2）*Hiroyuki Nishikawa1，Yoichi Sinzaki1，Kiyotaka Mitsumoto2，Hiroki Oshio2 |
| 13:00-14:50 | 2P050 |
Synthesis and properties of new radical salts of (S, S)-DM-MeDH-TTP （Department of Chemistry, Ibaraki University）*Takeshi Watanabe，Hiroyuki Nishikawa |
| 13:00-14:50 | 2P051 |
Synthesis and crystal structures of [Ni(dmit)2] salts with (4X-3-fluoroanilinium)(crown ether) supramolecular cations (X= F, Cl, Br) （RIES, hokkaido university）*Daigoro Endo，Kazuya Kubo，Shin-ichiro Noro，Takayoshi Nakamura |
| 13:00-14:50 | 2P052 |
Spin density distribution of TEMPOL investigate by solid-state high-resolution NMR （Faculty of Science, Hokkaido Univ.）*Goro Maruta，Sadamu Takeda |
| 13:00-14:50 | 2P053 |
Temperature dependence of the photoelectron spectra of Co(II) spin-crossover complexes with aromatic substituent （Graduate School of Science and Engineering,Ehime Univ.1，Graduate School oh Science and Technology,Kumamoto Univ.2）*Gaku Takasumi1，Hajime Yagi1，Takafumi Miyazaki1，Shinya Hayami2，Shojun Hino1 |
| 13:00-14:50 | 2P054 |
Ab-initio investigations on theoretically predicted perovskite and perovskite-like oxynitrides: novel materials for photocatalysis （Graduate School of Engineering,Univ. of Tokyo.）*Ayako Kubo，Giacomo Giorge，Koichi Yamashita |
| 13:00-14:50 | 2P055 |
Local structural analysis of in-doped zno by solid-state indium nmr （Graduate School of Natural Science & Technology, Kanazawa University1，National Institute for Materials Science2）*Ryutaro Ohashi1，Yuuji Kawamura1，Satoshi Miyashita1，Tomonori Ida1，Wataru Sato1，Motohiro Mizuno1，Masataka Tansho2，Tadashi Shimizu2 |
| 13:00-14:50 | 2P056 |
Theoretical prediction of the crystal structure in polycyclic aromatic organic semiconductors （NRI-AIST1，Toyohashi Univ. Tech.2）*Naoyuki Niitsu1，Shigeaki Obata1, 2，Toshiaki Miura1，Yukihiro Shimoi1 |
| 13:00-14:50 | 2P057 |
In situ DTA measurement of vapor-deposited isopropylbenzene glasses: Thermal changes accompanying structural relaxation （Graduate School of Science, Gakushuin University）*Tsubasa Hayakawa，Akira Nakao，Hideyuki Nakayama，Kikujiro Ishii |
| 13:00-14:50 | 2P058 |
Locally stable molecular conformations of alkylbenzene glasses studied by quantum chemical calculations: Intermolecular interaction through alkyl and phenyl groups （Graduate School of Science, Gakushuin Univ.）*Kio Omori，Hideyuki Nakayama，Kikujiro Ishii |
| 13:00-14:50 | 2P059 |
Angle-resolved specific heat measurements of the kappa type organic superconductors by the original calorimeter （Graduate School of Science, Osaka Univ.）*Shusaku Imajo，Shuhei Fukuoka，Satoshi Yamashita，Yasuhiro Nakazawa |
| 13:00-14:50 | 2P060 |
Structure and physical properties of novel organic conductors based on catechol-fused TTF derivative having an ethylenedioxy group （ISSP, Univ. of Tokyo）*Junya Yoshida，Akira Ueda，Hiromichi Kamo，Hatsumi Mori |
| 13:00-14:50 | 2P061 |
Molecular Motions in Organic Solids with Weak Charge-Transfer Interaction （Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1，Faculty of Science, Hokkaido Univ.2）*Shunsuke ASHIDATE1，Jun HARADA1, 2，Yukihiro TAKAHASHI1, 2，Tamotsu INABE1, 2 |
| 13:00-14:50 | 2P062 |
Crystals which jump upon irradiation with vsisible light : 6,13-diazapentacene （Graduate school of systems engineering, Wakayama Univ.1，Faculty of systems engineering, Wakayama univ.2）*Naoki Fukuyama1，Hideo Yamakado2 |
[Surface/Interface]
| 13:00-14:50 | 2P063 |
Temperature and coverage dependence of the adsorption structure of H2O on Pt(111) （Graduate School of Science, Kyoto Univ.）*Nao Okumura，Toshiki Sugimoto，Kazuya Watanabe，Yoshiyasu Matsumoto |
| 13:00-14:50 | 2P064 |
STM study of the rubrene films on HOPG （Osaka Univ.）*Yu Watanabe，Takahiro Ueba，Takashi Yamada，Hiroyuki Kato，Toshiaki Munakata |
| 13:00-14:50 | 2P065 |
Gas adsorption behavior and structure change of three dimensional Hofmann type porous coordination polymer nanofilm （Graduate School of Science, Kyoto Univ.1，Japan Science and Technology Agency-Core Research for Evolutionary Science and Technology2，National Institute for Materials Science/SPring-83，Japan Synchrotron Radiation Research Institute/SPring-84）*Tomoyuki Haraguchi1，Kazuya Otsubo1, 2，Osami Sakata3, 4，Akihiko Fujiwara4，Hiroshi Kitagawa1, 2 |
| 13:00-14:50 | 2P066 |
The performances and characteristics of the organic n-channel transistors with using various of electrodes （Graduate School of Hokkaido Univ.）*Kazuki Ito，Yukihiro Takahashi，Jyun Harada，Tamotsu Inabe |
| 13:00-14:50 | 2P067 |
Surface orientation behaviors in host-guest polymers studied with second harmonic methods （Graduate School of Engineering, Shizuoka Univ.）*Ryosuke Takasu，Kazuma Ito，Yasuaki Sato，Kenta Murakami，Yoshimasa Kawata，Shigeru Tasaka，Atsushi Sugita |
| 13:00-14:50 | 2P068 |
Elucidation of the mechanism of anomalous diffusion of guest molecules in the vicinity of interfaces of polymer solids by using three-dimensional single-molecule tracking （Graduate School of Engineering Science, Osaka Univ.1，Graduate School of Engineering, Osaka City Univ.2，Faculty of Engineering, Toyama Prefectural Univ.3）Yuhei Taga1，*Syoji Ito1，Satoshi Takei3，Daichi Kitagawa2，Seiya Kobatake2，Hiroshi Miyasaka1 |
| 13:00-14:50 | 2P069 |
Characterization of protein monolayers formed on controllable self-assembled monolayers using GFP （Graduate School of Science, Hiroshima Univ.1，HSRC, Hiroshima Univ.2）*Shin-ichi Wada1, 2，Jumpei Kajikawa1，Hironori Hayashita1，Ryosuke Koga1，Atsunari Hiraya1, 2 |
| 13:00-14:50 | 2P070 |
Probing Interaction of a Cell Penetrating Peptide with Lipid at Air/Water Interface Using Heterodyne-Detected Vibrational Sum Frequency Generation Spectroscopy （RIKEN）*Aniruddha Adhikari，Satoshi Nihonyanagi，Shoichi Yamaguchi，Tahei Tahara |
| 13:00-14:50 | 2P071 |
Solution structures of n-alcohols on mica investigated with frequency modulation atomic force microscopy （Graguate School of Science, Kobe Univ.）*Shunsuke Suiko，Takumi Hiasa，Kenjiro Kimura，Hiroshi Onishi |
| 13:00-14:50 | 2P072 |
Development of computer program "Calnos" for analyzing SFG and its application to surface of methanol/water mixture （Graduate School of Science, Tohoku Univ.）*Takashi Ishihara，Tatsuya Ishiyama，Akihiro Morita |
[Liquid phase]
| 13:00-14:50 | 2P073 |
Charge transfer absorption spectra of ionic liquids in bulk phase and near liquid-solid interface region （Department of Chemistry, Graduate School of Science and Engineering, Tokyo Institute of Technology）*Soh Yanagibashi，Takahiro Ogura，Kazuhiko Shibuya，Akio Kawai |
| 13:00-14:50 | 2P074 |
Correlation of Orientational relaxation time and vibrational frequency of iodine molecule in molecular and ionic liquids （Department of Chemistry, Gakushuin univeersity）*Takanori Uwabo，Koichi Iwata |
| 13:00-14:50 | 2P075 |
Ionic liquids from cationic 16 electron half-ruthenocenes exhibiting gas absorption （Graduate School of Science, Kobe University）*Shota Yamasaki，Tomoyuki Mochida |
| 13:00-14:50 | 2P076 |
Pulsed magnetic field effects on pyrene-based radical ion pair reactions （Graduate School of Science, Tokyo Univ.1，Graduate School of Arts and Sciences, Tokyo Univ.2）*Yuki Tachino1，Woodward Jonathan R.2，Takashi Nagata2 |
| 13:00-14:50 | 2P077 |
Observation of distance dependence of vibrational energy transfer in proteins by time-resolved anti-Stokes resonance Raman spectroscopy （Graduate School of science, Osaka Univ.）*Mitsuhiro Miyamoto，Misao Mizuno，Haruto Ishikawa，Yasuhisa Mizutani |
| 13:00-14:50 | 2P078 |
Ester gives larger attractive energy than ketone in supercritical CO2 : vibrational raman spectroscopic measurements and their theoretical analyses （Faculty of science, Hiroshima Univ.1，N-BARD, Hiroshima Univ.2，Graduate School of Science, Hiroshima Univ.3）*Masayoshi Imanishi1，Daisuke Kajiya1, 2，Ken-ichi Saitow1, 2, 3 |
| 13:00-14:50 | 2P079 |
Structure of [C4mim]BF4 − water mixture expressed by fluctuation （Graduate School of Advanced Integration Science, Chiba unv.）*Ayako Nitta，Takeshi Morita，Keiko Nishikawa |
| 13:00-14:50 | 2P080 |
Fluctuation structure of imidazolium-based ionic liquid [Cnmim][NTf2] (n = 2,4,8) and carbon dioxide mixtures （Chiba Univ.）*Shuhei Okumura，Takeshi Morita，Keiko Nishikawa |
| 13:00-14:50 | 2P081 |
Correlation between structural fluctuation and thermodynamic quantities for the supercritical n-pentane aqueous solution system （Graduate School of Advanced Integration Science, Chiba Univ.）*Satoshi Shibuta，Takeshi Morita，Keiko Nishikawa |
| 13:00-14:50 | 2P082 |
Solvation in supercritical ethanol/benzene binary systems studied by Raman spectroscopy and quantum-chemical calculations （Graduate School of Science, Gakushuin University）*Shiho Kamiyama，Hideyuki Nakayama，Kikujiro Ishii |
[Biomolecules]
| 13:00-14:50 | 2P083 |
Time-resolved study of structural fluctuation in protein reactions （Graduate School of Science, Kyoto Univ.1，Graduate School of Science, Osaka Prefecture Univ.2）*Yusuke Nakasone1，Kazunori Zikihara2，Satoru Tokutomi2，Masahide Terazima1 |
| 13:00-14:50 | 2P084 |
Fluctuation observed for short-lived intermediates in the photoreaction of the LOV2 domain of photoropin （Graduate School of Science, Kyoto Univ.1，Univ. of Maringa2，Osaka Prefecture Univ.3）*Kunisato Kuroi1，Francielle Sato2，Yusuke Nakasone1，Kazunori Zikihara3，Satoru Tokutomi3，Masahide Terazima1 |
| 13:00-14:50 | 2P085 |
Structural Dynamics of Hairpin RNA Measured by 2D Fluorescence Lifetime Correlation Spectroscopy （Molecular Spectroscopy Laboratory, RIKEN）*Chao-Han Cheng，Kunihiko Ishii，Tahei Tahara |
| 13:00-14:50 | 2P086 |
Differences in excitation energy transfer of Arthrospira platensis cells grown in seawater medium and freshwater medium, probed by time-resolved fluorescence spectroscopy （Graduate School of Science, Kobe University1，Graduate School of Engineering, Kobe University2，JST, CREST3，Molecular Photoscience Research Center, Kobe University4）*Muhammad Arba1，Shimpei Aikawa2, 3，Kenta Niki1，Makio Yokono3, 4，Akihiko Kondo2, 3，Seiji Akimoto1, 3, 4 |
| 13:00-14:50 | 2P087 |
Ab initio FMO calculations on specific interactions between aryl hydrocarbon receptor and exogenous/endogenous ligands （Toyohashi University of Technology1，RIKEN, AICS2，Corporate Research & Development Center, Toshiba Corporation3）*Satoshi Miyagi1，Kyoshiro Murata1，Kazuya Sashino1，Satoshi Sawamura1，Satoshi Ito2，Mitsuko Ishihara-Sugano3，Noriyuki Kurita1 |
| 13:00-14:50 | 2P088 |
[canceled]
Experimentally and theoretically studies of saccharides in aqueous solution with VUVCD spectroscopy to explore the origin of biological homochirality （Science and Technology, Tokai Univ.1，AIST2）*Yasuhiro Gunji1, 2，Masahito Tanaka2，Toshiyuki Inazu1，Shigeru Yamaguchi1 |
| 13:00-14:50 | 2P089 |
Effects of substrate strain on enzymatic activity: case study of ODCase catalysis （Nanosystem RI, AIST1，Graduate School of Science, Kyoto Univ.2）*Toyokazu ISHIDA1，Masahiro FUJIHASHI2 |
| 13:00-14:50 | 2P090 |
Theoretical studies on ATP hydrolysis in F1-ATPase and a rationally designed enzymatic reaction in its variants （Graduate School of Science, Kyoto Univ.）*Shiho Noguchi，Shigehiko Hayashi |
| 13:00-14:50 | 2P091 |
Computational study of RNA hydrolysis of RNaseHI （IPR, Osaka Univ.）*Yu Takano，Makoto Kita，Haruki Nakamura |
| 13:00-14:50 | 2P092 |
Free energy analyses for ATP hydrolysis using quantum mechanical /molecular mechanical simulations combined with a theory of solutions. （Graduate School of Science, Tohoku Univ.）*Yuji Miki，hideaki Takahashi，Akihiro Morita |
| 13:00-14:50 | 2P093 |
A theoretical study on the large conformational change of ADP/ATP carrier （Graduate School of Science, Kyoto Univ.）*Koichi Tamura，Shigehiko Hayashi |
[Theory/Calculation]
| 13:00-14:50 | 2P094 |
Theoretical study of the oxidation of methanol to formaldehyde by ruthenium(IV)-oxo complex （IMCE, Kyushu Univ.1，Univ. of Tsukuba2）*Shoya Takahashi1，Yoshihito Shiota1，Takahiko Kojima2，Kazunari Yoshizawa1 |
| 13:00-14:50 | 2P095 |
Theoretical study of pyrolysis of furan catalyzed by Ga-ZSM-5 （IMCE, Kyushu Univ.）*Tatsuya Suzuki，Syoya Takahashi，Yoshihito Shiota，Kazunari Yoshizawa |
| 13:00-14:50 | 2P096 |
Theoretical study on the degradation of bisphenol A by ferrate(VI) in water （IMCE, Kyushu Univ.）*Eiichirou Mori，Takashi Kamachi，Kazunari Yoshizawa |
| 13:00-14:50 | 2P097 |
An Efficient Procedure to Locate Buried Water Molecules in Proteins （IMCE, Kyushu University）*Tatsunobu Ogata，Takashi Kamachi，Kazunari Yoshizawa |
| 13:00-14:50 | 2P098 |
Asymmetric Diarylethene as a Dual-Functional Device Combining Switch and Diode （Institute for Materials Chemistry and Engineering and International Research Center for Molecular Systems, Kyushu University）*Junya Koga，Yuta Tsuji，Kazunari Yoshizawa |
| 13:00-14:50 | 2P099 |
Theoretical investigations of an aldol-type reaction with Rh complex （Graduate School of Science, Nagoya Univ.1，WPI-ITbM, Nagoya Uni.2）*Yoshio Nishimoto1, 2，Takahisa Fujimori1，Daisuke Yokogawa1, 2，Richiro Ushimaru1，Hiroshi Naka1，Susumu Saito1，Stephan Irle1, 2 |
| 13:00-14:50 | 2P100 |
Theoretical study on molecular structures and stability at the S2 state of OEC with different hydrogen bonding patterns （Graduate School of Engineering, Mie Univ.1，Engineering, Mie Univ.2）*Tomoya Ichino1，Nobuyuki Hoshiyama2，Masaki Mitani1，Yasunori Yoshioka1 |
| 13:00-14:50 | 2P101 |
Density functional study on proton transfer pathway of the EcClC antiporter （Graduate School of Engineering, Mie Univ.）*Masaki Mitani，Yasunori Yoshioka |
| 13:00-14:50 | 2P102 |
A Density Functional Study on Translocation of Metal Ions in the Cavity of the KcsA Potassium Channel （Graduate School of Engineering, Mie Univ.）*Mizuki Itoh，Masaki Mitani，Yasunori Yoshioka |
| 13:00-14:50 | 2P103 |
Energy analysis of molecular structures of a spin-labeled DNA duplex obtained by molecular mechanics approach （Graduate School of Science, Osaka City University1，The Institute of Scientific and Industrial Research, Osaka University2，Graduate School of Engineering Science, Osaka University3，FIRST-JSPS4）*Satoru Yamamoto1，Shigeaki Nakazawa1, 4，Kenji Sugisaki1, 4，Hiroshi Atsumi2，Kensuke Maekawa2，Kazunobu Sato1, 4，Kazuo Toyota1, 4，Daisuke Shiomi1, 4，Kazuhiko Nakatani2，Masahiro Kitagawa3, 4，Takeji Takui1, 4 |
| 13:00-14:50 | 2P104 |
Geometry optimization by the QM/MM calculation in a HIV protease complexes （Graduate School of Univ. of Tsukuba）*Tomoaki Kandatsu，kenji Morihashi |
| 13:00-14:50 | 2P105 |
Intramolecular electron transfer in polar solvents calculated by constrained density functional theory （Graduate School of Pure and Applied Sciences, University of Tsukuba）*Satoshi Muraoka，Kenji Morihashi |
| 13:00-14:50 | 2P106 |
Analytics of PPV's triplet-electron-transfer-process using CDFT （Graduate School of Pure and Applied Science, Univ. of Tsukuba）*Koharu AIKAWA，Norio TOMOTSU，Kenji MORIHASHI |
| 13:00-14:50 | 2P107 |
Hole mobility prediction of rubrene and tetracene （Graduate School of Pure and Applied Sciences, University of Tsukuba）*Kouichi Kase，Kenji Morihashi |
| 13:00-14:50 | 2P108 |
Theoretical study of electron mobility in amorphous phase of silole molecules （Faculty of Science, Osaka Pref. Univ.1，RIMED2）*Kotaro Maeda1，Toshio Asada1, 2，Shiro Koseki1, 2 |
| 13:00-14:50 | 2P109 |
Reexamination on phosphorescent processes in platinum complexes （Graducate School of Science, Osaka Prefecture University1，JNC Petrochemical Corporation2）*Shiro Koseki1，Toshio Asada1，Takeshi Matsushita2 |
| 13:00-14:50 | 2P110 |
Electronic structure calculation of (C^N)Pt(O^O) type complexes for OLED （Graduate School of Humanities and Sciences,Ochanomizu Univ.）*Mie Tanaka，Hirotoshi Mori |
| 13:00-14:50 | 2P111 |
Ab initio electronic structure calculations of thermally activated delayed fluoresce EL materials that consist of carbazoryl and dicyanobenzene （Graduate School of Humanities and Sciences, Ochanomizu Univ.）*Hirotoshi Mori |
| 13:00-14:50 | 2P112 |
Theoretical line intensities in B2Σ+―X2Σ+ absorption (0.0) band of CaH （Oita University1，Kyoto University, Kwasan Obserｖatory2）*Nobumitsu Honjou1，Mitsugu Makita2 |
| 13:00-14:50 | 2P113 |
Theoretical study of the molecular structures and the electronic excitation states of Iodine complexes （Graduate School of Science, Keio Univ）*Satoshi Tokumaru，Akihiro Imai，Satoshi Yabushita |
| 13:00-14:50 | 2P114 |
Theoretical study on the structure of methanolamine with water molecules （Faculty of Science, Josai University1，Tohoku Institute of Technology2）*Hiroyuki Teramae1，Yasuko Maruo2 |
| 13:00-14:50 | 2P115 |
Molecular Dynamics Study of Spatial and Dynamical Heterogeneities in Ionic Liquids （Institute for Molecular Science）*Tateki Ishida |
| 13:00-14:50 | 2P116 |
Optimizing minimum free energy crossing points in solution: A SF-TDDFT approach （FIFC, Kyoto Univ.）*Noriyuki Minezawa |
| 13:00-14:50 | 2P117 |
Theoretical study on the solvent effects of Prilezhaev reaction using QM/MC/FEP method （Graduate School of Science and Engineering Yamaguchi University）*Mitsuhiro Ogawa，Shiho Iwai，Michinori Sumimoto，Kenji Hori |
| 13:00-14:50 | 2P118 |
Theoretical investigation on the molecular and electronic structures of Ti(Pc)2 and Ti(Pc)2+ （Graduate School of Science and Engineering, Yamaguchi Univ.1，RIKEN AICS2，Graduate School of Science and Technology, Kumamoto Univ.3）*Michinori Sumimoto1，Yukio Kawashima2，Kenji Hori1，Hitoshi Fujimoto3 |
| 13:00-14:50 | 2P119 |
[canceled]
Quantum chemical research for reaction path of epoxidation with MnⅣsalen(MesIO)2Cl2 （Graduate School of Science and Engineering, Tokyo Metropolitan Univ.1，Institute for Molecular Science2，JST-CREST3）*Kensuke Inomata1, 3，Minori Abe1, 3，Hiroshi Fujii2，Masahiko Hada1, 3 |
| 13:00-14:50 | 2P120 |
Quantum-chemical Calculations of 195Pt-NMR Chemical Shifts in Pt-Porphyrins and the Effect of Ligands (Cl, Br, I, SCN) （Graduate School of Science, Tokyo Metropolitan Univ.1，JST-CREST2）*Toshiaki Kawamura1, 2，Kentaro Hayashi1，Satoshi Miyashita1，Kenichi Yamashita1，Motoko Asano1，Kenichi Sugiura1，Masahiko Hada1, 2 |
| 13:00-14:50 | 2P121 |
A LC-DFT+vdW study of the Diels-Alder reactions and the global hardness response analysis （Fuel Cell Nanomaterials Center, University of Yamanashi, Japan）*Raman Singh，Takao Tsuneda |
| 13:00-14:50 | 2P122 |
The density functional theory calculations of Sc2C2@C82 （Graduate School of Science and Engineering, Ehime Univ.）*Yuma Seino，Takahiro Hinoishi，Hajime Yagi，Takafumi Miyazaki，Shojun Hino |
| 13:00-14:50 | 2P123 |
A quantum chemical study on interlayer interaction of silicene （Graduate school of Yokohama National University）*Haruka Asano，Kota Sato |
| 13:00-14:50 | 2P124 |
Multicomponent molecular orbital study on positron attachment to a polar molecule LiH （Graduate School of Nanobioscience, Yokohama City Univ.）*Takayuki Oyamada，Masanori Tachikawa |
| 13:00-14:50 | 2P125 |
Theoretical analysis of positronic formaldehyde by using multi-component first principle method （Graduate school of nanobioscience, Yokohama City Univ.）*Yurika Yamada，Yukiumi Kita，Masanori Tachikawa |
| 13:00-14:50 | 2P126 |
Theoretical study on the mechanism of Ir catalyzed site-selective borylation of a C (sp3)-H bond in 2-alkylpyridines （Faulty of Science, Hokkaido University）*Min Gao，Satoshi Maeda，Tetsuya Taketsugu，Masaya Sawamura |
| 13:00-14:50 | 2P127 |
GRRM/AFIR study on the mechanism of asymmetric isocyanoacetate aldol reaction catalyzed by a chiral ferrocenylphosphine-gold(I) complex （Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1，Graduate School of Science, Hokkaido Univ.2）*Chiaki Koike1，Satoshi Maeda2，Tetsuya Taketsugu2，Masaya Sawamura2 |
| 13:00-14:50 | 2P128 |
GRRM/AFIR study on the mechanism of vinylogous Mannich-type reaction with 2-trimethylsiloxy furan: kinetic control vs. thermodynamic control （Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1，Department of Chemistry, Faculty of Science, Hokkaido Univ.2）*Ryohei Uematsu1，Satoshi Maeda2，Tetsuya Taketsugu2 |
| 13:00-14:50 | 2P129 |
H-H bond activation by Aun-mAgm clusters (n = 7-9) : GRRM study on the reactivity （Faculty of Science, Hokkaido Univ.1，Graduate School of Science, Hokkaido Univ.2，ESICB, Kyoto Univ.3）*Makito Takagi1，Min Gao2，Satosi Maeda2, 3，Tetuya Taketugu2, 3 |
| 13:00-14:50 | 2P130 |
Kinetic analysis of catalytic cycles on the basis of path searching by GRRM/AFIR and modeling by Transition State Theory -Regio- and stereo-selectivity with considering competition of multiple pathways- （Hokkaido Univ.1，Hokkaido Univ.2）*Yosuke Sumiya1，Satoshi Maeda2，Tetsuya Taketsugu2 |
| 13:00-14:50 | 2P131 |
GRRM study for mechanism of carbonylation reactions catalyzed by Pd ion-containing immobilized ionic liquid catalyst （Graduate School of Frontier Sciences, The University of Tokyo1，ICT2）*Takehiko Sasaki1，Mayur V. Khedkar2，Bhalchandra M. Bhanage2 |
| 13:00-14:50 | 2P132 |
Replica MD and ab initio fragment MO calculations for global searching stable conformations of amyloid-β dimer in water （Toyohashi University of Technology1，Murata Manufacturing Co., Ltd.2）*Akisumi Okamoto1，Atsushi Yano1，Kazuya Nomura1，Shinichi Higai2，Noriyuki Kurita1 |
| 13:00-14:50 | 2P133 |
The effect of C-terminal residue of amyloid-β on its dimer formation: classical MD and ab initio fragment MO calculations （Toyohashi University of Technology Graduate School1，Murata Manufacturing Co., Ltd.2）*Atsushi Yano1，Akisumi Okamoto1，Kazuya Nomura1，Shinichi Higai2，Noriyuki Kurita1 |
| 13:00-14:50 | 2P134 |
Ab initio molecular simulations for Porous Coordination Polymers （Toyohashi University of Technology1，Murata Manufacturing Co.,Ltd.2）*Takuya Sugimoto1，Akisumi Okamoto1，Atsushi Yano1，Shinichi Higai2，Takuo Wakaoka2，Noriyuki Kurita1 |
| 13:00-14:50 | 2P135 |
Theoretical study on the geometric and the formation of s-d hybridization of aluminum cluster doped copper atom （Graduate School of Tchnology, Chiba Institute of Technology）*Chiaki Ishibashi，Kaoru Onoe，Hidenori Matsuzawa |
| 13:00-14:50 | 2P136 |
Theoretical study of hydrogen absorption on LiAln-(n=1-7) cluster （Graduate School of Technology, Chiba Institute of Technology）*Fumihiro Kusama，Yukari Isogai，chiaki Ishibashi，Hidenori Matsuzawa |
| 13:00-14:50 | 2P137 |
Theoretical study on the reaction of metastable diacetylene with ground state propyne in titan's atmosphere - formation reactions of C5H4 and C5H3 - （Graduate School of Technology, Chiba Institute of Technology）*Daisuke Nawata，Hidenori Matsuzawa |
| 13:00-14:50 | 2P138 |
Theoretical Study of Dynamics of molecules on the Excited State in Solid States （Dept. Molecular Engineering, Graduate School of Engineering, Kyoto University1，ESICB, Kyoto University2，Department of Applied Chemistry and Biochemistry, Faculty of Engineering, Kyushu Sangyo University3）*Masahiro Narita1，Hirofumi Sato1, 2，Yoshihide Nakao3 |
| 13:00-14:50 | 2P139 |
A DFT study of Rh dimer adsorption on AlPO4(110) surface （ESICB, Kyoto Univ.1，FIFC, Kyoto Univ.2）*Masafuyu Matsui1，Shigeyoshi Sakaki1, 2 |