Oral Sessions
Tuesday, September 24 (Starting at 9:00)
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 | 3P001 |
Electronic spectra of (trifluoromethoxy)benzene derivatives: An identification of rotational isomer and anomalous vibronic structures （College of Science and Engineering, Aoyama Gakuin University）*Tasuku Isozaki，Ryoichi Yasuda，Tadashi Suzuki |
| 13:00-14:50 | 3P002 |
FTIR studies of the 15NO3 14NO3 n3+n4 band and analysis of vibration-rotation interaction （Graduate School of Natural Science and Technology, Okayama Univ.1，Solar-Terrestrial Environment Laboratory, Nagoya Univ.2，Hiroshima City Univ.3）*Kentarou Kawaguchi1，Ryuji Fujimori2，Jian Tang1，Takashi Ishiwata3 |
| 13:00-14:50 | 3P003 |
High-resolution infrared emission spectrum of GaH and the non-Born-Oppenheimer analysis （Graduate School of Science, Josai University.1，Faculty of Science, Josai University.2）*Naoki Fushimi1，Masanao Ishiduka2，Koui Horiai1，Hiromichi Uehara1 |
| 13:00-14:50 | 3P004 |
Anharmonicity of the molecular vibration in the large-amplitude motion for the CF3 group in methyl trifluoroacetate （Graduate School of Science and Technology, Sophia Univ.1，Graduate school of Science, Hokkaido Univ.2）*Atsushi Ishikawa1，Nobuhiko Kuze1，Maho Kohno1，takayuki Kobayashi1，Takemasa Tsuji2，Hiroshi Takeuchi2，Shigehiro Konaka2 |
| 13:00-14:50 | 3P005 |
Ultraviolet absorption spectra of N3 in solid nitrogen （National Synchrotron Radiation Research Center, Taiwan1，Department of Applied Chemistry, National Chiao Tung University, Taiwan2）*Yu-Jong Wu1，Shiang-Jiun Chuang1，Tzu-Ping Huang1，Henryk A. Witek2 |
| 13:00-14:50 | 3P006 |
High resolution UV-IR double resonance spectroscopy of small alcohols （Graduate School of Natural Science, Okayama Univ.）*Kazuhiro Nishiguchi，Yuki Miyamoto，Jian Tang，Kentaro Kawaguchi |
| 13:00-14:50 | 3P007 |
Studies on reaction dynamics in the multi-degree-of-freedom system by using the orientation-orientation vector correlation （Graduate School of Science, Osaka Univ.）*Hiroshi Ohoyama，Yuusuke Matsuura |
| 13:00-14:50 | 3P008 |
Ultrafast dynamics of aromatic molecules studied with 157 nm VUV short pulses at 1kHz repetition rate （Graduate School of Science. Kyoto Univ.1，JST/CREST2）Takuya Horio1, 2，*Takufumi Kobayashi1，Spesyvtsev Roman1, 2，Toshinori Suzuki1, 2 |
| 13:00-14:50 | 3P009 |
Kinetic analysis of the formation of I2 profile in the photolysis of CH3I. （Tokyo Gakugei University1，Graduate School of Information Sciences, Hiroshima City University2）*Shohei Matsuda1，Yukio Nakano1，Takashi Ishiwata2 |
| 13:00-14:50 | 3P010 |
Investigation of the formation mechanism of nitrophenols from the reaction of NO3 radical with phenol. （Tokyo Gakugei University1，Graduate School of Information Sciences, Hiroshima City University2）*Yukio Nakano1，Shohei Matsuda1，Tamami Yakgi1，Takashi Ishiwata2 |
| 13:00-14:50 | 3P011 |
Theoretical study on the size dependence of excited state proton transfer in 1-naphthol-ammonia clusters （Chemical Resources Laboratory, Tokyo Institute of Technology）*Toshihiko Shimizu，Shunpei Yoshikawa，Mitsuhiko Miyazaki，Masaaki Fujii |
| 13:00-14:50 | 3P012 |
Symmetry assignment to Low-lying electronic excited states of jet-cooled molecules by polarization two-photon excitation spectroscopy （nihon univ1，nihon univ2）*Daiki Ogata1，Katsuhiko Okuyama2 |
| 13:00-14:50 | 3P013 |
Theoretical study of dihydrogen bonding in phenol-silane clusters （College of Liberal Arts and Sciences, Kitasato University1，School of Science, Kitasato University2）*Kota Daigoku1，Haruki Ishikawa2 |
| 13:00-14:50 | 3P014 |
Fluctuation of hydrogen bond in hydrated benzyl alcohol cluster cations revealed by gas-phase spectroscopy （Kyushu University）*Takamasa Ikeda，Kenji Sakota，Hiroshi Sekiya |
| 13:00-14:50 | 3P015 |
The structure of estrogens and their physiological properties studied by laser spectroscopy and quantum chemical calculation （Graduate School of Science, Hiroshima Univ.）*Fumiya Morishima，Yoshiya Inokuchi，Takayuki Ebata |
| 13:00-14:50 | 3P016 |
Gas-phase structural determination of an artificial sweetener aspartame by IR-UV double resonance spectroscopy （Yokohama City Univ.）*Daisuke Nakamura，Hiroyuki Saigusa |
| 13:00-14:50 | 3P017 |
Structural and electronic properties of vanadium-benzene sandwich clusters （Keio Univ.1，JST-ERATO2）*Tsugunosuke Masubuchi1，Takeshi Iwasa1, 2，Atsushi Nakajima1, 2 |
| 13:00-14:50 | 3P018 |
Reactivity of VO radical with hydrocarbon and cavity ringdown spectroscopic detection. （Japan women's Univ.）*Tamaki Matsumoto，Yukiko Kaneko，Kayo Maeda，Nami Yamakita，Takashi Imajo |
| 13:00-14:50 | 3P019 |
Development of a Penning electron spectrometer for clusters （Graduate School of Informatics and Engineering, UEC1，Faculty of Informatics and Engineering, UEC2）*Naoya Miyauchi1，Yutaro Nakajima2，Masahiro Ota2，Taiki Tanaka2，Moto Zaizen1，Yoshihiro Yamakita1 |
| 13:00-14:50 | 3P020 |
Structures and dissociation processes of metal-amino acid complexes （Graduate School of Science, Osaka Prefecture Univ.1，Graduate School of Science, Osaka Univ.2）*Yuki Sha1，So Matsuo1，Akimasa Fujihara1，Michisato Toyoda2，Shigeo Hayakawa1 |
| 13:00-14:50 | 3P021 |
Photodissociation dynamics of acetone studied by time-resolved electron momentum spectroscopy: data analyses and theoretical calculations （Institute of Multidisciplinary Research for Advanced Materials, Tohoku Univ.）*Keiya Oishi，Masakazu Yamazaki，hiroyuki nakazawa，Yuji Kasai，Masahiko Takahashi |
| 13:00-14:50 | 3P022 |
Interatomic Coulombic decay of Xe dimers observed by photoelectron-photoion coincidence velocity imaging spectroscopy （Graduate School of Science, Tohoku Univ.1，Faculty of Science, Tohoku Univ.2，RIKEN AMO Phys. lab.3，KEK IMSS4）*Naoki Kishimoto1，Takaki Tokiwa1，Hiroto Taga2，Tomoya Mizuno3，Akira Yagishita4 |
| 13:00-14:50 | 3P023 |
Laser-polarization effects on multiphoton absorption of molecules with spherical symmetry （Graduate School of Science,Tohoku Univ.）*Nobuyoshi Inada，Manabu Kanno，Hirohiko Kono |
| 13:00-14:50 | 3P024 |
Controlling the orientation of CO molecules with combined fs laser and THz pulses: Temperature effects （Graduate School of Science, Tohoku Univ.）*Masataka Yoshida，Kaoru Nakashima，Yukiyoshi Ohtsuki，Hirohiko Kono |
| 13:00-14:50 | 3P025 |
Optimizing isotope-selective molecular alignment induced by laser pulse （Graduate School of Science, Tohoku Univ.）*Kaoru Nakashima，Yukiyoshi Ohtsuki，Hirohiko Kono |
[Clusters/Particles/Nanostructures]
| 13:00-14:50 | 3P026 |
Charge state of protein molecules in the gas phase produced by ir-laser ablation of droplet beam （Gakushuin University）*Kensuke Komatsu，Mariko Nagasaka，Jun-ya Kohno |
| 13:00-14:50 | 3P027 |
Protrusion formation during the collisional process of ethanol and water droplets:Capillary wave propagation on the water droplet （Gakushuin University）*Tomoko SUZUKI，Makoto Kobayashi，Jun-ya Kohno |
| 13:00-14:50 | 3P028 |
Scanning cavity enhanced Raman spectroscopy of ethanol （Gakushuin University）*Masaki Sekiguchi，Naoya Miyauchi，Mariko Nagasaka，junya Kohno |
| 13:00-14:50 | 3P029 |
Measurements and analyses of infrared absorption spectra of radical ions of sumanene （Grad. Sch. of Sci. & Eng., Saitama Univ.1，Col. of Sci. & Eng., Aoyama Gakuin Univ.2，Institute for Molecular Science3）*Yuya Nakama1，Akira Sakamoto2，Hidehiro Sakurai3，Shuhei Higashibayashi3 |
| 13:00-14:50 | 3P030 |
Electron transportation of gold nanoparticle network connected with viologen-type molecular wires （Graduate School of Arts and Science, The University of Tokyo1，Graduate School of Science, Nagoya University2，Faculty of Science, Kanagawa University3）*Kiyoto Omata1，Taro Toyota1，Michio M. Matsushita2，Kentaro Suzuki3，Tadashi Sugawara3 |
| 13:00-14:50 | 3P031 |
Enhancement of catalytic activity of water splitting photocatalysts by loading metal clusters precisely synthesized as co-catalysts （Tokyo University of Science）*Michiyo Hirayama，Mamiko Omatoi，Yoshiki Matsuura，Ryota Tomizawa，Tomoaki Takayama，Akihide Iwase，Akihiko Kudo，Yuichi Negishi |
| 13:00-14:50 | 3P032 |
Rapid spontaneous alloying between Au@Rh nanorods and Ag nanoprisms in aqueous solution at ambient temperature （Department of Applied Science for Electronics and Materials, Graduate School of Engineering Sciences, Kyushu Univ.1，Institute for Materials Chemistry and Engineering, Kyushu Univ.2）*Yukinori Nakashima1，Koiti Takemura1，Masashi Hattori2，Masaharu Tsuji2 |
| 13:00-14:50 | 3P033 |
Functionalized nanowires based on copper- and silver-acetylides （Meisei Univ.）*Junichi Nishijo |
| 13:00-14:50 | 3P034 |
High sensitive detection of antigen-antibody reaction using quantum crystal SERS substrate （Graduate School of Chemistry, Kwansei Univ.1，Mytech2，HRI, AIST3）*Daichi Araki1，Yuki Hasegawa2，Katuyuki Hasegawa2，Yuko Yamamoto3，Tamitake Ito3，Yasutaka Kitahama1，Yukihiro Ozaki1 |
| 13:00-14:50 | 3P035 |
Theoretical analysis of the binding energy and hydrogen bond network in water clusters (n≦25) （Faculty of Science and Technology, Keio Univ.）*Suehiro Iwata |
| 13:00-14:50 | 3P036 |
Ultrafast dynamics of novel aromatic micelles encapsulating fluorescent dyes （RIKEN1，Tokyo Tech2）*Matthew Sartin1，Kei Kondo2，Michito Yoshizawa2，Tahei Tahara1 |
| 13:00-14:50 | 3P037 |
Synthesis and interfacial properties of fullerene derivatives amphiphilized by sulfation （Aichi Univ. of Education）*Kazuyuki Hino，Tomohiro Ida，Takumi Ito，Ryosuke Endo，Narumi Kawai，Hirofumi Nakano，Koji Miura |
| 13:00-14:50 | 3P038 |
Observation of plasmon dephasing processes in gold nanorods by ultrafast time-resolved near-field optical microscopy （Institute for Molecular Science1，The Graduate Univ. for Advanced Studies2，Waseda Univ., School of Advanced Science and Engineering3）*Yoshio Nishiyama1，Tetsuya Narushima1, 2，Kohei Imura3，Hiromi Okamoto1, 2 |
| 13:00-14:50 | 3P039 |
Photoelectron spectra of endohedral metallofullerene Er3N@C80 （Graduate School of Science and Engineering, Ehime University1，Institutes for Molecular Science, Okazaki2，Graduate School of Science, Nagoya University3）*Takahiro Hinoishi1，Yuma Seino1，Hajime Yagi1，Takafumi Miyazaki1，Tatsuhiko Nishi2，Hisanori Shinohara3，Shojun Hino1 |
| 13:00-14:50 | 3P040 |
Dynamics study on the Zn-cluster surface in sub-critical water （Innovation Center, RIKEN）*Makoto Hatakeyama，Shinichiro Nakamura |
| 13:00-14:50 | 3P041 |
Development of apparatus for reactivity evaluation of trapped single particle catalyst produced from liquid droplet （gakushuin university1，Graduate School of Science, gakushuin Univ.2）*tetsu higashiura2，junya kono1 |
| 13:00-14:50 | 3P042 |
Electric field effects on photoexcitation dynamics of photofunctional materials: charge transfer process in excited states （RIES, Hokkaido Univ.）Takakazu Nakabayashi，Ruriko Ohshima，*Nobuhiro Ohta |
[Solid phase]
| 13:00-14:50 | 3P043 |
Fluorescence spectra of cyanostilbene derivative with aggregation induced enhanced emission （Faculty of Education, Shinshu Univ.）*Jun-ichi Fujimori，Fuyuki Ito |
| 13:00-14:50 | 3P044 |
Infrared spectroscopy of specific organic crystals：Intermolecular double-hydrogen bond ribbons dominate molecular vibrations （Fac. of Sci., Kyushu Univ.1，IMCE, Kyushu Univ.2，Chiba Univ. of Tech.3，BASE, Tokyo Univ. Agri. and Tech.4）*Kazuko Ohyama1，Kenta Goto2，Teruo Shinmyozu2，Norifumi Yamamoto3，Munetaka Nakata4，Hiroshi Sekiya1 |
| 13:00-14:50 | 3P045 |
Electronic structures of cyclic thiazyl biradical BDTDA thin films （Department of Nanomaterials Science, Chiba Univ.1，RCMS, Nagoya Univ.2）*Rie Suizu1，Kenta Morioka1，Kunio Awaga2，Kazuyuki Sakamoto1 |
| 13:00-14:50 | 3P046 |
New ET-based quantum spin liquid utilizing tetrahedral anion （Faculty of Agric., Meijo Univ.1，Graduate School of Eng., Nagoya Univ.2，Graduate School of Sci., Kyoto Univ.3，Graduate School of Sci., Nagoya Univ.4）*Yukihiro Yoshida1，Hiroshi Ito2，Mitsuhiko Maesato3，Yasuhiro Shimizu4，Takaaki Hiramatsu1，Gunzi Saito1 |
| 13:00-14:50 | 3P047 |
Synthesis and properties of DT-TTF analogs containing seleniums （Ehime university）*Keisuke Furuta，Shuhei Kohno，Takashi Shirahata，Yohji Misaki |
| 13:00-14:50 | 3P048 |
Uniaxial strain dependence of MI transition of (BDA-TTP)2FeCl4 （Dept. chem., TMU1，Univ of Hyogo2）*Kenji Usui1，Wataru Fujita1，Takeshi Kodama1，Koichi Kikuchi1，Junichi Yamada2 |
| 13:00-14:50 | 3P049 |
Synthesis and Properties of Fused TTF-DT Donors and TTF Donors with a Dithiane Ring （Graduate School of Science, Hyogo Univ.）*Yuto Hachiken，Hiroki Akutsu，Shin-ichi Nakatsuji，Jun-ichi Yamada |
| 13:00-14:50 | 3P050 |
Novel magnetic properties of metal oxides in solid-state electrochemistry （Research Center for Materials Science, Nagoya Univ.1，CREST2，Graduate School of Science, Nagoya Univ.3）*Tetsuya Yamada1, 2，Kantaro Morita3，Hirofumi Yoshikawa3，Kunio Awaga1, 2 |
| 13:00-14:50 | 3P051 |
Crystal structure and magnet properties of two-dimensional square-lattice magnet, bis(glycolato)copper(Ⅱ), Cu(HOCH2COO)2. （Dept.Chem.,TMU1，Graduate School of Science, Osaka Pref Univ.2）*Shouta Yoneyama1，Takeshi Kodama1，Koichi Kikuchi1，Yohei Kawabata1，Kentaro Kikuchi2，Toshio Ono2，Yuko Hosokoshi2，Wataru Fujita1 |
| 13:00-14:50 | 3P052 |
Ab initio study on the cathode material Na2FePO4F of sodium ion batteries （Dept. of Chemical System Eng. The Univ. of Tokyo）*Ryo Ubagai，Kenta Tsubakiyama，Koichi Yamashita |
| 13:00-14:50 | 3P053 |
Synthesis, crystal structure and Mg ionic conductivity of MgAl2X8(X=Cl,Br) （Guraduate School of Engineering, Shizuoka Univ.1，College of Industrial Technology, Nihon Univ.2）*Yasumasa Tomita1，Makoto Morishita1，Kenkichiro Kobayashi1，Koji Yamada2 |
| 13:00-14:50 | 3P054 |
Redox of quinone dioximes and their application to organic secondary battery （Osaka Electro-Communication Univ.1，Murata Manufacturing Co. Ltd.2）*Yuta Nishimura1，Shuji Aonuma1，Masaharu Satoh2 |
| 13:00-14:50 | 3P055 |
Structural study of amine and alkylammonium molecules intercalated in donor-type ternary graphite intercalation compounds （Graduate School of Natural Science & Technology, Okayama University1，Graduate School of Natural Science and Technology, Kanazawa University2）*Kazuma Gotoh1，Tatsuya Miyato2，Motohiro Mizuno2，Takashi Kambe1，Hiroyuki Ishida1 |
| 13:00-14:50 | 3P056 |
Crystal Structures and Recognizing Ionic Valence Dependent Redox Properties of Quinone- Hydroquinone-Fused Crown-Ethers （Tohoku University Department of Applied Chemistry, Graduate School of Engineering1，Tohoku University Institute of Multidisciplinary Research for Advanced Materials2）*Takayuki Kobayashi1，Takashi Takeda1, 2，Norihisa Hoshino1, 2，Tomoyuki Akutagawa1, 2 |
| 13:00-14:50 | 3P057 |
Preparations, Crystal Structures, and Redox Properties of Nitrogen- and Sulfur-Containing Hetero-Ring Fused p-Benzoquinone Derivatives （Graduate School of engineering, Tohoku Univ.1，Institute of Multidisciplinary Research for Advanced Materials2）*Masahiro Sato1，Takashi Takeda1, 2，Norihisa Hoshino1, 2，Tomoyuki Akutagawa1, 2 |
| 13:00-14:50 | 3P058 |
Single crystal and randomly oriented ESR spectra of a binuclear rhenium complex with hydrogen-bonded biimidazolate ligands in a mixed-valence state （Graduate School of Science, Osaka City University1，Faculty of Science, Tokyo University of Science2，FIRST-Quantum Information Processing Project3）*Takeshi Yamane1，Kazunobu Sato1, 3，Kenji Sugisaki1, 3，Kazuo Toyota1, 3，Daisuke Shiomi1, 3，Makoto Yoshizawa2，Makoto Tadokoro2，Takeji Takui1, 3 |
| 13:00-14:50 | 3P059 |
Local Structure and Molecular Motions in Imidazolium Malonate Crystal （Graduate School of Natural Science & Technology, Kanazawa Univ.1，National Institute for Materials Science2）*Mizuki Chizuwa1，Tsuyoshi Umiyama1，Ryutaro Ohashi1，Tomonori Ida1，Motohiro Mizuno1，Masataka Tansho2，Tadashi Shimizu2 |
| 13:00-14:50 | 3P060 |
New ionic plastic crystals formed by divalent ions in a new class of plastic crystals （Graduate School of Nanobioscience, Yokohama City Univ.）*Satoru Hirakawa，Hisashi Honda |
| 13:00-14:50 | 3P061 |
Molecular dynamics in nano channel of chiral metal-organic framewarks （Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1，Graduate School of Science, Hokkaido Univ.2）*Jyunya Okamoto1，Naoki Muramatsu1，Yoshiyuki Kageyama2，Goro Maruta2，Sadamu Takeda2 |
[Surface/Interface]
| 13:00-14:50 | 3P062 |
Control of Single-molecule switching （Graduate School of Science, Kyoto Univ.）*Satoru Habuka，Yuya Kitaguchi，Hiroshi Okuyama，Shinichirou Hatta，Tetsuya Aruga |
| 13:00-14:50 | 3P063 |
2PPE-PEEM study on resonant excitation at a rubrene/graphite interface （Graduate School of Science, Osaka Univ.）*Kyohei Wakayama，Christian Udhardt，Takahiro Ueba，Takashi Yamada，Hiroyuki Kato，Toshiaki Munakata |
| 13:00-14:50 | 3P064 |
Characterization of binary-mixed self-assembled monolayers by using MALDI-TOF mass spectrometry （Graduate School of Science, Hiroshima Univ.1，HSRC, Hiroshima Univ.2）*Kenji Miyatake1，Shin-ichi Wada1, 2，Junpei Kajikawa1，Atsunari Hiraya1, 2 |
| 13:00-14:50 | 3P065 |
Specific electronic decay of the N 1s hole of 3-methylpyrrole （Graduate School of Science, Hiroshima Univ.1，HSRC, Hiroshima Univ.2）*Kazumasa Okada1, 2，Shin-ichi Wada1, 2 |
| 13:00-14:50 | 3P066 |
Single-molecule spectroscopy of a D-π-D quadrupolar dye : Correlation between conformation and electronic localization （Graduate school of science,Shizuoka Univ.）*Masashi Nakamoto，Hiroshi Fujiwara，Kenji Kobayashi，Masaaki Mitsui |
| 13:00-14:50 | 3P067 |
The second harmonic generations in hosts-guest polymer excited by Surface Plasmon enhanced optical fields （Graduate School of Engineering,Shizuoka Univ.）*Tomoyuki Sato，Kname Sudo，Atsushi Ono，Yoshimasa Kawada，Atsushi Sugita |
| 13:00-14:50 | 3P068 |
Novel organic photocells operated by electric double layers in ionic liquids （Graduate School of Science, Nagoya Univ.1，Japan Society for the Promotion of Science2，Research Center for Materials Science3）*Sho Fukuoka1，Simon Dalgleish2，Kunio Awaga3 |
| 13:00-14:50 | 3P069 |
Theoretic calculation of acidity of water solution surface （Graduate School of Science, Tohoku Univ.）*Yusuke Tabe，Nobuaki Kikkawa，Hideaki Takahashi，Akihiro Morita |
| 13:00-14:50 | 3P070 |
Thermal behavior of water on the surface and in the interlayer of bentonite （Graduate School of Integrated Basic Science ,Nihon Univ.1，Department of Chemistry, College of Humanities and Sciences,Nihon Univ.2，Department of Geosystem sciences,College of Humanities and Sciences, Nihon Univ.3）*Yoshiharu Ito1，Atsushi Nagoe2，Hiroki Fujimori2，Takato Takemura3 |
[Liquid phase]
| 13:00-14:50 | 3P071 |
Monte Carlo Studies of the Pressure-Induced Phase Transition of Lennard-Jones Fluid System and the Structures of Solid States （School of International Liberal Studies, Chukyo Univ.）*Chizuru Muguruma |
| 13:00-14:50 | 3P072 |
Spatial-decomposition approach to ion-pair dynamics relevant to electric conductivity （Inst. Chem. Res., Kyoto Univ.）Kai-Ming Tu，*Nobuyuki Matubayasi |
| 13:00-14:50 | 3P073 |
Development of the thickness-variable liquid jet sheet for terahertz spectroscopy （JAEA）*Masato Kondoh，Ryuji Itakura，Masaaki Tsubouchi |
| 13:00-14:50 | 3P074 |
The molecular structural factor of various local anesthetics in regulation of indometacin hydrophobicity （Tokyo University of Science ,Pharmaceutical Department）*Ryo Tateuchi，Naoki Sagawa，Syusuke Osozawa，Yohsuke Shimada，Satoru Goto |
| 13:00-14:50 | 3P075 |
Hydrophobic solute effect on fluctuation of 2-butoxyethanol-water mixture using small-angle X-ray scattering （Graduate School of Advanced Integration Science, Chiba University1，Graduate School of Science, Tohoku University2）*Takeshi Morita1，Syuichi Toyouchi2，Shinji Kajimoto2，Hiroshi Fukumura2，Keiko Nishikawa1 |
| 13:00-14:50 | 3P076 |
Thermal properties of citric acid and sodium-citrate aqueous solutions （Graduate School of Integrated Basic Sciences,Nihon Univ1，College of Humanities and Sciences,Nihon Univ2）*Atsushi Yamamoto1，Hiroki Fujimori2，Atsushi Nagoe2 |
| 13:00-14:50 | 3P077 |
Dynamical molecular behavior and liquid property of fluorinated fatty acids （Graduate School of Science, Kitasato Univ.1，School of Science, Kitasato Univ.2）*Shun Yamamoto1，Yasutoshi Kasahara2，Hideyuki Minami2，Hideyo Matsuzawa2，Makio Iwahashi2，Haruki Ishikawa2 |
| 13:00-14:50 | 3P078 |
Structural change of water-AOT reverse micelles in carbontetrachloride upon a laser-induced temperature jump （Graduate School of Science, Tohoku Univ.）*Yuta Kotaki，Shinji Kajimoto，Hiroshi Fukumura |
| 13:00-14:50 | 3P079 |
Molecular dynamics study of free energy profile of solubilization of insoluble molecules in ionic SDS and non-ionic C12E8 micelles （Graduate School of Engineering, Nagoya Univ.1，Department of pharmacy, Ritsumeikan Univ2，Center for Computational Science of Graduate School of Engineering, Nagoya Univ3）*Hiroaki Takabayashi1，kazushi Fujimoto2，Noriyuki Yoshii3，Susumu Okazaki1 |
| 13:00-14:50 | 3P080 |
DSC and NMR measurements of a liquid crystal, MBBA, confined within mesoporous silica （Graduate School of Integrated Basic Science, Nihon Univ.1，Department of Chemistry, College of Humanities and Sciences, Nihon University2）*Takehisa Yoshimi1，Ayumi Shima2，Shoko Hagiwara1，Hiroki Fujimori2 |
| 13:00-14:50 | 3P081 |
Melting behavior of disubstituted thiophene solid solution system in silica-gel nano-pores （Graduate School of Integrated Basic Science ,Nihon Univ.）*Shun Sakai，Yuko Inoue，Sho Noguchi，Atsushi Nagoe，Hiroki Fujimori |
| 13:00-14:50 | 3P082 |
Reactions of materials for CO2 separation and capture (4) NMR spectral analysis （Research Institute of Innovative Technology for the Earth1，Advanced Technology Research Laboratories, Nippon Steel & Sumitomo Metal Corporation2）*Hidetaka Yamada1，Kazuya Goto1，Takayuki Higashii1，Yoichi Matsuzaki2 |
| 13:00-14:50 | 3P083 |
Second component doping effects of atomization for water （Graduate School of Integrated Basic Sciences, Nihon Univ.1，Department of Chemistry, College of Humanities and Sciences,2，SHINCRON CO.,LTD.3）*Yutaka Hara1，Kousuke Takayasu2，Rumi Hukuti2，Atusi Nagoe1，Hiroki Fujimori1，Sinitirou Saisyo3，Daisuke Yamada3 |
[Biomolecules]
| 13:00-14:50 | 3P084 |
Single molecule spectroscopy of photosynthetic reaction center at cryogenic temperature （Department of Physics, Tokyo Institute of Technology1，Institute for Protein Research, Osaka University2，Graduate School of Science, Osaka University3）*Toru Kondo1，Risa Mutoh2，Genji Kurisu2，Hirozo Oh-oka3，Satoru Fujiyoshi1，Michio Matsushita1 |
| 13:00-14:50 | 3P085 |
Anti-Stokes fluorescence imaging of thylakoid membrane with near infra-red light excitation （Grad. Sch. of Sci., Kyoto Univ.1，PRESTO JST2，Grad. Sch. Life and Environment, Kyoto Pref. Univ.3）*Shigeichi Kumazaki1, 2，Masashi Akari1，Makoto Hasegawa1，Masahide Terazima1，Takashi Shiina3 |
| 13:00-14:50 | 3P086 |
3D sectioned wide-field Raman imaging microscopy with structured illumination （National Chiao Tung University）*Rintaro Shimada，Hiro-o Hamaguchi |
| 13:00-14:50 | 3P087 |
Reflecting Objective with a numerical aperture of 0.97 and its application to single-molecule fluorescent imaging at 1.5 K （Graduate School of Science and Technology, Tokyo Tech.）*Hironori Inagawa，Michio Matsushita，Satoru Fujiyoshi |
| 13:00-14:50 | 3P088 |
Single-molecule fluorescence imaging of three‐dimensional localization of dye molecules at 1.5 K （Graduate School of Science and Technology, Tokyo Tech.1，Graduate School of Medicine, Kyoto Univ.2, Graduate School of Bioscience and Biotechnology, Tokyo Tech.3，Institute of Biomaterials and Bioengineering, Tokyo Medical and Dental University.4）*Yasuharu Toratani1，Minako Maruo1，Hironori Inagawa1，Isao Kii2，Nobuhiro Hayashi3，Takamitsu Hosoya4,Michio Matsushita1，Satoru Fujiyoshi1 |
| 13:00-14:50 | 3P089 |
Mechanical stabilization of a microscopic system of the single protein fluorescence imaging at 1.5 K （Graduate school of science and technology,Titech）*Keisuke Wakao，Yuki Hamada，Takuya Hinohara，Michio Matsushita，Satoru Fujiyoshi |
| 13:00-14:50 | 3P090 |
Observation of excitation energy transfer process in the cyanobacterium Synechococcus sp. PCC7002 under nutrient-deficient conditions （Graduate School of Science, Kobe University.1，Molecular Photoscience Research Center, Kobe University.2，JST CREST3，Graduate School of Engineering, Kobe University.4）*Kenta Niki1，Makio Yokono2, 3，Shimpei Aikawa3, 4，Akihiko Kondo3, 4，Seiji Akimoto1, 2, 3 |
| 13:00-14:50 | 3P091 |
Large-scale all-atom molecular dynamics calculation of viruses using the K-computer. 3. A stable structure of poliovirus capsid in solution. （Graduate School of Engineering, Nagoya Univ.1，Graduate School of Engineering, Nagoya Univ.2，Faculty of Pharmaceutical Sciences, Ritsumeikan Univ.3，Institute for Protein Research, Osaka Univ.4，Institure of Mictrovial Chemistry5）*Hidekazu Kojima1，Noriyuki Yoshii2，Atsushi Yamada1，Yoshimichi Ando1，Kazushi Fujimoto3，Keisuke Mizutani1，Susumu Okazaki1，Atsushi Nakagawa4，Akio Nomoto5 |
| 13:00-14:50 | 3P092 |
Large-scale all-atom molecular dynamics calculation of viruses using the K-computer 5. Exchange of water molecules across poliovirus capsid （Graduate School of Engineering, Nagoya Univ.1，Graduate School of Engineering, Nagoya Univ.2，Faculty of Pharmaceutical Sciences, Ritsumeikan Univ.3，Institute for Protein Research, Osaka Univ.4，Institute of Mictrovial Chemistry5）*Atsushi Yamada1，Noriyuki Yoshii2，Yoshimichi Andoh1，Kazushi Fujimoto3，Hidekazu Kojima1，Keisuke Mizutani1，Susumu Okazaki1，Atsushi Nakagawa4，Akio Nomoto5 |
| 13:00-14:50 | 3P093 |
Slow dynamics of protein backbone dihedral angles revealed by time-structure based independent component analysis （Yokohama City Univ.）*Sotaro Fuchigami |
[Theory/Calculation]
| 13:00-14:50 | 3P094 |
Development of analytical energy gradient for two-component relativistic time-dependent density functional theory （Faculty of Regional Studies, Gifu Univ.1，RIKEN AICS2）*Muneaki Kamiya1, 2，Takahito Nakajima2 |
| 13:00-14:50 | 3P095 |
Two-component relativistic coupled-cluster methods for ground and excited states of molecules （RIKEN AICS）*Yoshinobu Akinaga，Takahito Nakajima |
| 13:00-14:50 | 3P096 |
Highly accurate calculation of huge molecules with massively parallelized MP2-F12 method （Graduate School of System Informatics, Kobe Univ.1，Institute for Molecular Science2）*Yu-ya Ohnishi1，Ishimura Kazuya2，Seiichiro Ten-no1 |
| 13:00-14:50 | 3P097 |
Difference density matrix analysis: application to substituent effects and intermolecular interactions (2) （RIST）*Daisuke Yamaki |
| 13:00-14:50 | 3P098 |
Development of molecular orbital program using script language （Research Institute for Information Technology, Kyushu Univ.1，Faculty of Information Science and Electrical Engineering, Kyushu Univ.2，Institute of Systems, Information Technologies and Nanotechnologies3，None4）*Hiroaki Honda1，Yuichi Inadomi2，Jun Maki3，Takeshi Noro4 |
| 13:00-14:50 | 3P099 |
Sapporo basis set: Relativistic segmented contraction basis sets with core-valence correlation effects for actinoid atoms （Tomakomai Komazawa Univ.1，no affiliation2，Graduate School of Engineering, Muroran Institute of Technology3）*Masahiro Sekiya1，Takeshi Noro2，Toshikatsu Koga3 |
| 13:00-14:50 | 3P100 |
Fock matrix calculation with GPGPU for OpenFMO （CCS, Univ. Tsukuba）*Hiroaki Umeda，Toshihiro Hanawa，Mitsuo Shoji，Taisuke Boku |
| 13:00-14:50 | 3P101 |
Construction of NBMO and Localization of HOMO in Finite Length Zigzag Nanotubes （Meiji Pharmaceutical University）*Noriyuki Mizoguchi |
| 13:00-14:50 | 3P102 |
Excited states and interactions of molecules in proteins and solutions （CRC, Hokkaido Univ.1，TCCI2）*Jun-ya Hasegawa1，Kazuya Ishimura2 |
| 13:00-14:50 | 3P103 |
Algorithm to search stable structures on free energy surface using QM/MM method （Department of Chemistry, Osaka Pref. Univ.1，RIMED2）*Toshio Asada1, 2 |
| 13:00-14:50 | 3P104 |
Estimation of electronic coupling values in Fragment-DFT calculation （Faculty of Pharmacy, Yasuda Women's University1，Department of Chemistry, University of Tsukuba2）*Yasuyo Shimodo1，Kenji Morihashi2 |
| 13:00-14:50 | 3P105 |
Development of the IMiC-MO method for large-scale transition metal complexes （Gifu University）*Taro Udagawa，Shogo Sakai |
| 13:00-14:50 | 3P106 |
Structural analysis of protein hydration water by means of sparse model （Materials Sci., JAIST1，Knowledge Sci., JAIST2）*Taku Mizukami1，Ayumu Sugiyama2，Takafumi Kawasaki2，Hiroyuki Takagi2，Bao Ho Tu2，Chi Dam Hieu2 |
| 13:00-14:50 | 3P107 |
Prediction of binary alloy property from the simulation data by using L1 type regularization linear regression model （School of knowledge science, JAIST1，School of materials science, JAIST2）*Daisuke Suzuki1，Takafumi Kawasaki1，Ayumu Sugiyama1，Taku Mizukami2，Chi Dam Hieu1 |
| 13:00-14:50 | 3P108 |
Photophysical processes of uracil derivatives in solution phase. （Graduate School of Chemical Sciences and Engineering, Hokkaido University1，Faculty of Science, Hokkaido University2，Graduate School of Science and Technology, Hirosaki University3）*Masayuki Okai1，akira Nakayama2，Syohei Yamazaki3，Tetsuya Taketsugu2 |
| 13:00-14:50 | 3P109 |
A new surface hopping AIMD approach utilizing wavepacket simulation and its application to azobenzene photoisomerization （Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1，Graduate School of Science, Hokkaido Univ.2）*Yusuke Kondo1，Takao Kobayashi1，Yu Harabuchi2，Takeshi Noro2，Tetsuya Taketsugu2 |
| 13:00-14:50 | 3P110 |
AIMD-WKB approach to tunneling splitting due to proton transfer in the excited state of tropolone （Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1，Graduate School of Science, Hokkaido Univ.2，NIMS3）*Aya Satoh1，Yu Harabuchi2，Yusuke Ootani3，Tetsuya Taketsugu2 |
| 13:00-14:50 | 3P111 |
Dependency of the CN-stretching frequency on the environment in water-acetonitrile mixture （Graduate School of Science, Kyoto Univ.1，UHH, MPSD, CFEL2）*Seiji Ueno1，Taisuke Hasegawa2，Nils Huse2 |
| 13:00-14:50 | 3P112 |
Nonlinear field effects on quantum control of chemical reactions （JAEA1，Princeton Univ.2）*Yuzuru Kurosaki1，Tak-San Ho2，Herschel Rabitz2 |
| 13:00-14:50 | 3P113 |
Diabatic Potential for Proton Transfer between Imidazole Molecules （Graduate School of Natural Science and Technology, Kanazawa University）*Yuta Hori，Tomonori Ida，Motohiro Mizuno |
| 13:00-14:50 | 3P114 |
Vibrational quasi-degenerate perturbation theory based on optimized vibrational coordinates （RIKEN）*Kiyoshi Yagi，Hiroki Otaki |
| 13:00-14:50 | 3P115 |
Quantum Monte Carlo study of isotope effect on dielectric phase transition in hydrogen-bonded molecular crystal （RIKEN1，Graduate School of Science, Kyoto Univ.2）*Hiroki Otaki1，Koji Ando2 |
| 13:00-14:50 | 3P116 |
Ln dependence in the detachment energies of Ln(COT)2- complexes （Graduate School of Science and Technology, Keio Univ.）*Erika Nakajo，Tomohide Masuda，Satoshi Yabushita |
| 13:00-14:50 | 3P117 |
The theoretical study on the interaction potential of the photoprocusts I+CN in the photodissociation of ICN （Graduate School of Science and Technology, Keio Univ.）*Tomoya Ikezaki，Yusuke Ohta，Satoshi Yabushita |
| 13:00-14:50 | 3P118 |
Multi-canonical study on the C-terminal domain of RNA Pol2 （Kinki Univ. Inst. Adv. Tech.）*Yasushige Yonezawa |
| 13:00-14:50 | 3P119 |
Molecular dynamics simulation of a peptide by helix-strand replica-exchange method （Inst. Mol. Sci.1，SOKENDAI2）*Hisashi Okumura1, 2，Satoru Itoh1, 2 |
| 13:00-14:50 | 3P120 |
Bond path of hydrated electron （Graduate School of Science and Technology, Tokyo Metropolitan Univ.）*Kiyoaki Kitayama，Ryotaro Tazawa，Kenro Hashimoto |
| 13:00-14:50 | 3P121 |
Precise vibrational analysis of multi-minima and dissociative systems （Graduate School of Science and Technology, Tokyo Metropolitan Univ.）*Masaki Mamiya，Hibiki Iwase，Kiyoaki Kitayama，Kenro Hashimoto |
| 13:00-14:50 | 3P122 |
Crystal structure prediction of polycyclic aromatic hydrocarbons via a Buckingham potential model （Graduate School of Informatics and Engineering, UEC）*Ryo Ito，Yoshihiro Yamakita |
| 13:00-14:50 | 3P123 |
Theoretical search of the adsorbent molecules for hydrogen with a middle adsorption force using light metals （School of Science, Tokai Univ.）*Akira Sakamoto，Shigeru Ishikawa |
| 13:00-14:50 | 3P124 |
First-Principles Molecular Dynamics Study on Redox Potential Evaluation of Ferrocene-Terminated Self-Assembled Monolayers （Graduate School of Engineering Science, Osaka Univ.1，Graduate School of Engineering, Osaka Univ.2）*Sumito Akiyama1，Yukio Kaneda1，Yasuyuki Yokota1，Koji Inagaki2，Yoshitada Morikawa2，Ken-ichi Fukui1 |
| 13:00-14:50 | 3P125 |
Structural analysis of the metal complex formed on the pore-wall of mesoporous organic-silica hybrids. （Toyota Central R&D Labs., Inc.1，ACT-C2，Graduate School of Medicine, Okayama Univ.3，Graduate School of Science, Nagoya Univ.4，Institute of Molecular Science5，Research Center for Materials Science, Nagoya Univ.6）*Soichi Shirai1, 2，Yoshifumi Maegawa1, 2，Minoru Waki3，Satoshi Muratsugu4, 5，Mizuki Tada6, 5，Shinji Inagaki1, 2 |
| 13:00-14:50 | 3P126 |
Theoretical study on the physical adsorption of saturated hydrocarbons on the metal surface （School of Advanced Science and Engineering, Waseda University1，Research institute for Science and Engineering, Waseda University2，CREST, Japan Science and Technology Agency3，Elements strategy Initiative for Catalysts and Batteries4）*Yusuke Tsukamoto1，Yasuhiro Ikabata1，Hiromi Nakai1, 2, 3, 4 |
| 13:00-14:50 | 3P127 |
Theoretical study on de-solvation properties of career-ions in secondary batteries （Graduate School of Advanced Science and Engineering, Waseda University1，Graduate School of Engineering, The University of Tokyo2，ESICB, Kyoto University3，Research Institute for Science and Engineering, Waseda University4，CREST, Japan Science and Technology Agency5）*Masaki Okoshi1，Yuki Yamada2, 3，Atsuo Yamada2, 3，Hiromi Nakai1, 3, 4, 5 |
| 13:00-14:50 | 3P128 |
Predictions of the properties of organic solution electrolytes using computational chemistry （TAIYO YUDEN CO., LTD.1，School of Advanced Science and Engineering, Waseda University2，Research Institute for Science and Engineering, Waseda University3，ESICB, Kyoto University4，CREST, Japan Science and Technology Agency5）*Teruo Atsumi1，Takeo Tsuzuki1，Yoshiki Iwazaki1，Katsuei Ishida1，Masaki Okoshi2，Takeaki Kaiho2，Hiromi Nakai2, 3, 4, 5 |
| 13:00-14:50 | 3P129 |
The effect of electron-phonon interaction on the optical properties of zinc-blende GaN （School of Engineering, The University of Tokyo1，Institut Laue Langevin2，Istituto di Struttura della Materia of the National Research Council3，European Theoretical Spectroscopy Facilities (ETSF)4）*Hiroki Kawai1，Koichi Yamashita1，Elena Cannuccia2，Andrea Marini3, 4 |
| 13:00-14:50 | 3P130 |
Theoretical study of the surface complex of dicyanomethylene compounds and TiO2 （Department of Chemical System Engineering, School of Engineering, The University of Tokyo1，Research Center for Advanced Science and Technology, The University of Tokyo2）*Yuhei Shimoda1，Ryota Jono1，Morio Nagata2，Jun-ichi Fujisawa2，Hiroshi Segawa2，Koichi Yamashita1 |
| 13:00-14:50 | 3P131 |
Chirality Dependence of Quantum Thermal Transport in Carbon Nanotubes at Low Temperatures （Graduate School of Engineering, Tokyo Univ.）*Tomoyuki Hata，Hiroki Kawai，Tatsuhiko Ohto，Koichi Yamashita |
| 13:00-14:50 | 3P132 |
DFT calculations for chlorine elimination from chlorine-adsorbed gold （Graduate school of science, Osaka Univ.1，ESIB, Kyoto Univ.2）*Kohei Tada1，Koki Ueda1，Sachio Hayashi1，Kohei Sakata1，Shusuke Yamanaka1，Yasutaka Kitagawa1，Takashi Kawakami1，Mitsutaka Okumura1, 2 |
| 13:00-14:50 | 3P133 |
Theoretical study of the zero-field splitting on Mn12O12 Single Molecule Magnet （School of Science, Osaka Univ.）*Shohei Yoshimura，Keiji Kinoshita，Takashi Kawakami，Yasutaka Kitagawa，Shusuke Yamanaka，Mitsutaka Okumura |
| 13:00-14:50 | 3P134 |
Analysis of electronic structure of chlorine adsorbed gold clusters based on linear response function （Graduate School of Science, Osaka Univ.1，TOYOTA Physical & Chemical Research Institute2，Protein Institute, Osaka Univ.3）*Koki Ueda1，Kohe Tada1，Kyohe Komi1，Shusuke Yamanaka1，Takashi Kawakami1，Yasutaka Kitagawa1，Haruki Nakamura3，Kizashi Yamagushi2，Mitsutaka Okumura1 |
| 13:00-14:50 | 3P135 |
A theoretical approach for QM/MM boundary problems based on spin density and bond-order versions of linear response functions （Graduate School of Science, Osaka University1，NEC Corporation2，Toyota Physical & Chemical Research Institute3，Protein Institute, Osaka University4）*Shusuke Yamanaka1，Kazuto Nakata2，Yasutaka Kitagawa1，Takashi Kawakami1，Kizashi Yamaguchi3，Mitsutaka Okumura1，Haruki Nakamura4 |
| 13:00-14:50 | 3P136 |
Highly efficient analyses of I-M-I transition in quasi-1D metal complexes by elongation method （Department of Material Sciences, Faculty of Engineering Sciences, Kyushu Univ.1，JST-CREST2）*Kai Liu1，Yuuichi Orimoto1，Yuriko Aoki1, 2 |
| 13:00-14:50 | 3P137 |
Functional properties and electronic states of metal included BN/C heteronanotubes by Elongation method （Interdisciplinary Graduate School of Engineering Sciences, Kyushu Univ.1，Research Institute for Information Technology, Kyushu Univ.2，JST-CREST3）*Ryota Tsutsui1，Kai Liu1，Yuuichi Orimoto1，Hiroaki Honda2，Yuriko Aoki1, 3 |
| 13:00-14:50 | 3P138 |
Development of open-shell elongation method and its application to ferromagnetic material design （Interdisciplinary Graduate School of Engineering Sciences, Kyushu Univ.1，JST-CREST2）*Xun Zhu1，Kai Liu1，Yuuichi Orimoto1，Yuriko Aoki1, 2 |
| 13:00-14:50 | 3P139 |
Through-space/bond interaction analysis on NLO properties enhancement of molecular switches （Interdisciplinary Graduate School of Engineering Sciences, Kyushu Univ.1，JST-CREST2）*Lizhi Jiang1，Yuuichi Orimoto1，Yuriko Aoki1, 2 |