Oral Sessions

Saturday, September 19 (Starting at 9:00)

For each presentation, the alphabet in the Presentation Number indicates the location, the first digit the day of the presentation (the 1st, 2nd, 3rd, or 4th day of the meeting), and the last two the order within each day for that venue.
You can open an abstract (pdf file) by following a link of Presentation Number from this web site.

Saturday Morning Sessions(September 19, starting at 9:00)

Venue A  [Gas phase]

9:18-9:364A02Study on photoisomerization of methylcinnamate derivatives by low-temperature matrix-isolated FTIR and supersonic jet laser spectroscopy
(Graduate School of Science, Hiroshima Univ.1,Graduate School of BASE, Tokyo University of A and T2,Institute for Molecular Science3,Graduate University for Advanced Studies4)*Yasunori Miyazaki1,Yoshiya Inokuchi1,Takayuki Ebata1,Airi Tamaki1,Satoshi Kojima1,Nobuyuki Akai2,Yuki Kanazawa3,4,Masahiro Ehara3
9:36-9:544A03Photoreaction mechanism of thiazole isolated in low-temperature argon matrices
(Institute of Engineering, Tokyo Univ. Agriculture and Technology1,Graduate School of BASE, Tokyo Univ. Agriculture and Technology2)*Jun Miyazaki1,Masaya Miyagawa2,Hiroshi Takiyama1,Munetaka Nakata2
9:54-10:124A04Penning ionization of anisole analogues having intramolecular rotation
(The University of Electro-Communications1,University of Toyama2)*Ishiguro Yuki1,Masahiro Ota1,Yoshihiro Yamakita1,Naoto Hayashi2
10:12-10:304A05Dynamics study of the multichannel photodissociation of nitromethane by the measurement of all degrees of freedom of the photofragments
(Graduate School of Science, Hiroshima Univ.)*Masataka Sumida,Katsuyoshi Yamasaki,Hiroshi Kohguchi
10:30-10:40
Break
10:40-10:584A06Insertion of atomic gold anion into carbon–halogen bond of haloalkanes
(The Univ. of Tokyo1,ESICB, Kyoto Univ.2)*Satoru Muramatsu1,Kiichirou Koyasu1,2,Tatsuya Tsukuda1,2
10:58-11:164A07Ion imaging study of fragment ions from Mg+-methyl halide complex ion using a reflectron mass spectrometer
(Graduate School of Science, Tohoku Univ.)*Kenichi Okutsu,Kenichiro Yamazaki,Keijiro Ohshimo,Fuminori Misaizu
11:16-11:344A08Proton transfer reactions of biomolecular ions in the gas phase
(Graduate School of Nanobioscience, Yokohama City Univ.)*Shinji Nonose,Hideo Isono,Hiroki Akiyama,Taiju Tanimura,Masato Miyazawa
11:34-11:524A09Simulation of transition state spectra of the I + HI reaction and vibrational bonding in IMuI
(Graduate School of Science and Engineering, Saitama Univ.)*Takahiko Yoshida,Kazuma Sato,Toshiyuki Takayanagi
11:52-12:104A10Hydrogen scrambling in ethane dication by first-principle molecular dynamics calculation
(School of Science, The University of Tokyo)*Katsunori Nakai,Tsuyoshi Kato,Kaoru Yamanouchi

Venue B  [Liquid phase]

9:00-9:184B01Rate constants of addition reaction of radical to olefin measured by pulsed EPR method and theoretical analysis of the activation energy
(Tokyo Tech)*Hirona Takahashi,Akio Kawai
9:18-9:364B02The anion dependence of phosphorescence peak wavelength of O2 a(1Δg)-X(3Σg-) transition in ionic liquids
(Tokyo Tech1,Univ. of Hyderabad2)*Tsuyoshi Yoshida1,Akio Kawai1,Dinesh Khara2,Samanta Anunay2
9:36-9:544B03Measurements for charge transfer quenching rate constants of singlet oxygen in piperidinium ionic liquid
(Tokyo Tech.)*Mai Katou,Tsuyoshi Yoshida,Akio Kawai
9:54-10:124B04Photochromism of a Phenoxyl-Imidazolyl Radical Complexes Having Thiophene Backbone
(Aoyama Gakuin University1,CREST2)*Takahiro Ikezawa1,Katsuya Mutoh1,Hiroaki Yamashita1,Yoichi Kobayashi1,Jiro Abe1,2
10:12-10:304B05Ultrafast Photodissociation Dynamics of Phenoxyl-Imidazolyl Radical Complex
(School of Sci. Eng., Aoyama Gakuin Univ.1,Graduate School of Eng. Sci., Osaka University2,Center for Quantum Sci. and Tech. under Extreme Conditions, Osaka University3,CREST4)*Yoichi Kobayashi1,Tetsuro Katayama2,Yusuke Yoneda2,Hiroaki Yamashita1,Hiroshi Miyasaka2,3,Jiro Abe1,4
10:30-10:40
Break
10:40-10:584B06Highly sensitive two-photon absorption measurement of diarylpolyynes using optical-probing photoacoustic spectroscopy
(Aoyama Gakuin University)*Tasuku Isozaki,Sho Kinoshita,Ryo Takeuchi,Tadashi Suzuki
10:58-11:164B07Experimental test of the relationship between spin selective chemical reactions and quantum measurements
(Graduate School of Science and Engineering, Saitama University1,University of Oxford2,Arizona State University3)*Kiminori Maeda1,Ayaka Suda1,Peter Hore2,Devens Gust3,Paul Liddell3
11:16-11:344B08Magnetic interactions in excited states of lanthanide single-molecule magnets with radical
(Osaka Univ.)*Kazuro Kizaki,Yutaro Sakaguchi,Akira Fuyuhiro,Takamitsu Fukuda,Naoto Ishikawa
11:34-11:524B09Paramagnetic shift analysis of the NMR chemical shift of Tb(III)-phthalocyaninato single-molecule magnets
(Graduate School of Science, Tohoku Univ.1,Institute of Inorganic Chemistry, Heidelberg Univ2,CREST (JST)3)*Takaumi Morita1,Marko Damjanovic2,Keiichi Katoh1,3,Markus Enders3,Brian k. Breedlove1,Masahiro Yamashita1,3

Venue C  [Biomolecules]

9:00-9:184C01UV resonance Raman studies on the common mechanism of the acquisition of pro-oxidant activity in fALS-linked SOD1 mutants
(Graduate School of Pharmaceutical Sciences, Tohoku Univ.)*Nobuhiro Fujimaki,Ken Nishiya,Takashi Miura,Takakazu Nakabayashi
9:18-9:364C02Excited-state dynamics of biomolecules studied by time-resolved circular dichroism spectroscopy
(Graduate School of Science, UTokyo1,Graduate School of Arts and Sciences, UTokyo2)*Kotaro Hiramatsu1,Takashi Nagata2
9:36-9:544C03Analysis of the hydration effect and the secondary structure dependence of the infrared intensities of the amide II modes of peptides
(Faculty of Education, Shizuoka Univ.)*Hajime Torii,Magumi Kawanaka
9:54-10:124C04Real time observation of NO reduction of nitric oxide reductase by microfluidic flow-flash infrared spectroscopy
(RIKEN, Spring-81,Grad. Sch. Life Sci., Univ. of Hyogo2,PRESTO, JST3)*Tetsunari Kimura1,Shoko Ishii1,2,Takehiko Tosha1,Yoshitsugu Shiro1,2,Minoru Kubo1,3
10:12-10:304C05Quantitative Raman spectrometry of complex mixture systems by hypothetical addition multivariate analysis with numerical differentiation
(Waseda University1,National Chiao Tung University2)*Masahiro Ando1,Hiro-o Hamaguchi2,1
10:30-10:40
Break
10:40-10:584C06Blind separation of overlapped fluorescence signals using three-dimensional correlation spectroscopy
(Mol. Spectrosc. Lab., RIKEN)*Kunihiko Ishii,Tahei Tahara
10:58-11:164C07FTIR study of specific hydrogen-bond of Tyrosine in the protein
(Grad. Sch.Eng., Nagoya Inst. Tech.,1,Prest, JST2)*Shota Ito1,Shinya Sugita1,Rei Abe-yoshizymi1,Keiichi Inoue1,2,Tatsuya Iwata1,Masayo Iwaki1,Hideki Kandori1
11:16-11:344C08Macroscopic motion of supramolecular polymer driven by azobenzene photoisomerization induced phase transition
(Faculty of Science, Hokkaido Univ.1,JST PRESTO2,Grad. Sch. Chem. Sci. Eng.3)*Yoshiyuki Kageyama1,2,Tomonori Ikegami3,Yuta Kurokome3,Sadamu Takeda1
11:34-11:524C09Structural changes in retinal chromophore of Gloeobacter rhodopsin facilitating the proton pump function
(Graduate School of Science, Osaka University1,Nagoya Institute of Technology2)Ayumi Nakajima1,*Misao Mizuno1,Hideki Kandori2,Yasuhisa Mizutani1
11:52-12:104C10Transient optical absorption and magnetic intensity modulation based microscopy of photochemical reaction intermediates
(Graduate School of Arts and Sciences, University of Tokyo)Joshua Beardmore,Lewis Antill,*Jonathan Woodward

Venue D  [Solid phase]

9:18-9:364D02Proton conduction properties of coordination polymer complexes with a possible active-transport
(Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1,Faculty of Science, Hokkaido Univ.2)*Yuki Ohta1,Yoshiyuki Kageyama2,Goro Maruta2,Sadamu Takeda2
9:36-9:544D03External Electric Filed Effects on Excited-State Intramolecular Proton Transfer of 4′-N,N-dimethylamino-3-hydroxyflavone in PMMA films
(Kyushu Univ.1,Aichi Univ. of Edu2,Chiba Inst. of Tech3,National Chiao Tung Univ.4,Tohoku Univ.5)*Kazuki Furukawa1,Kazuyuki Hino2,Norifumi Yamamoto3,Kamlesh Awassthi4,Takakazu Nakabayashi5,Nobuhiro Ohta4,Hiroshi Sekiya1
9:54-10:124D04Ferroelastcic phase transition mechanism and dynamic characteristics of n-alkylammonium dihydrogen phosphate
(Graduate School of Engineering, Tohoku Univ.1,IMRAM, Tohoku University2)*Akira Yasuda1,Norihisa Hoshino1,2,Takashi Takeda1,2,Tomoyuki Akutagawa1,2
10:12-10:304D05Shear stress- and visible light- induced photochromism on diarylethenes
(Tokyo Univ. of Sci., Yamaguchi Graduate School of Sci. & Eng.1,Faculty of Engineering, Tokyo Univ. of Sci., Yamaguchi2)*Takeshi Inoue1,Yusuke Funasako2,Makoto Inokuchi2
10:30-10:40
Break
10:40-10:584D06Phase manipulation of vibrational wavefunction of solid para-hydrogen using 2D spatial light modulator
(Nara institute of science and technology1,JST PRESTO2,Institute for Molecular Science3,Sokendai4)*Hiroyuki Katsuki1,2,Kenzo Ohmori1,Toru Horie1,Hisao Yanagi1,Kenji Ohmori3,4
10:58-11:164D07Study of decrease in the HOMO-LUMO gap observed in solids of alkanes
(School of Science and Engineering, Kinki Univ.1,School of Science and Technology, Kwansei Gakuin Unv.2,NFRI, NARO3,IMS4)*Yusuke Morisawa1,Shin Tachibana2,Akifumi Ikehata3,Masahiro Ehara4,Yukihiro Ozaki2
11:16-11:344D08High resolution infrared spectroscopy of CH3F in solid para-H2
(Graduate School of Science, Tokyo Institute of Technology)*Hiroyuki Kawasaki,Asao Mizoguchi,Hideto Kanamori
11:34-11:524D09Rapid estimation of charge carrier mobility in amorphous organic materials using a percolation corrected random-walk model
(SHARP Labs of America Inc.1,Schrödinger, Inc.2,Materials & Energy Technology Laboratories, Sharp Co.3)David Evans1,Mathew Halls2,*Masahito Oh-e3
11:52-12:104D10Development of new complexes using lignin biomass with pyrone rings
(Grad. Sch. Sci. and Engin., Hosei Univ.1,Research Center for Micro-Nano Technol., Hosei Univ.2,Forestry and Forest Products Research Institute3)*Hironori Ogata1,2,Yuichiro Otsuka3,Masaya Nakamura3

Venue E  [Theory/Calculation]

9:18-9:364E02Theoretical study on the two-photon transition properties of open-shell one-dimensional molecular aggregates
(Graduate School of Engineering Science, Osaka Univ.1,Department of Chemical Engineering, Nara National College of Technology2)*Ryohei Kishi1,Naoyuki Matsushita1,Michika Saito1,Kyohei Yoneda2,Masayoshi Nakano1
9:36-9:544E03Isomerization of Ru(II)-sulfur dioxide complex in crystal; Theoretical study with QM/MM approach
(Fukui Institute for Fundamental Chemistry, Kyoto Univ.)*Shinji Aono,Shigeyoshi Sakaki
9:54-10:124E04Metadynamics of polyalcohol dehydration in water
(Institute for Molecular Science (IMS)1,Japan Atomic Energy Agency (JAEA)2,Departament de Química-Física i CERQT, Universitat de Barcelona3)*Sergi Ruiz-barragan1,2,Jordi Ribas-ariño3,Motoyuki Shiga2
10:12-10:304E05A novel scheme for designing light-control pulse by coupled Maxwell-Schrödinger equations: Optimal control for a quasi-one-dimensional single-electron quantum dot
(College of Science and Technology, Nihon Univ.)*Takashi Takeuchi,Shinichiro Ohnuki,Tokuei Sako
10:30-10:40
Break
10:40-10:584E06Development of linear response function of bond order and its applications
(Graduate School of Science, Osaka Univ.1,Insitute for NanoScience Design, Osaka Univ.2,Protein Institute, Osaka Univ.3)*Shusuke Yamanaka1,Yuki Mitsuta1,Nayuta Suzuki1,Toru Saito1,Takashi Kawakami1,Kizashi Yamaguchi2,Mitsutaka Okumura1,Haruki Nakamura3
10:58-11:164E07Theoretical study on the open-shell nature, aromaticity and optical response properties of extended indenofluorene systems
(Graduate School of Engineering Science, Osaka Univ.1,Department of Chemical Engineering, NNCT2)*Kotaro Fukuda1,Takanori Nagami1,Kyohei Yoneda2,Masayoshi Nakano1
11:16-11:344E08Theoretical study on conjugated Si – Si bonds on third order nonlinear optical properties
(Graduate School of Engineering Science, Osaka Univ.)*Hiroshi Matsui,Kotaro Fukuda,Takanori Nagami,Masayoshi Nakano
11:34-11:524E09Theoretical design of singlet fission molecules: Controlling diradical character of polyaromatic hydrocarbons by substituting groups or by distorting frameworks
(Graduate School of Engineering Science, Osaka University1,Graduate School of Science, Osaka University2)*Soichi Ito1,Takanori Nagami1,Takashi Kubo2,Masayoshi Nakano1
11:52-12:104E10Quantum control for molecular spin quantum computers: Indirect implementation of multi-qubit quantum gates via hyperfine interactions
(Graduate School of Science, Osaka City University)*Taiki Shibata,Satoru Yamamoto,Shigeaki Nakazawa,Elham Hosseini,Kenji Sugisaki,Koji Maruyama,Kazuo Toyota,Daisuke Shiomi,Kazunobu Sato,Takeji Takui

Saturday Afternoon Sessions(September 19, starting at 14:50)

Venue A  [Gas phase]

14:50-15:084A11Interference effects in electron momentum density distributions of SF6
(IMRAM, Tohoku Univ.)*Noboru Watanabe,Masakazu Yamazaki,Masahiko Takahashi
15:08-15:264A12The S1 electronic state of toluene studied by time-resolved (e,2e) electron momentum spectroscopy
(IMRAM, Tohoku Univ.1,USTC2)*Masakazu Yamazaki1,Yaguo Tang2,Masahiko Takahashi1
15:26-15:444A13Chirality recognition of gas-phase anions by imaging photoelectron circular dichroism
(Graduate School of Arts and Sciences, The University of Tokyo)*Nakanishi Ryuzo,Nagata Takashi
15:44-16:024A14Dynamics of photochemical reaction in 1,2-butadiene studied by time-resolved photoelectron spectroscopy
(Graduate School of Engineering,Hokkaido Univ.1,Graduate School of Science,Hokkaido Univ.2,Materials & Structures Laboratory,Tokyo Inst. Tech.3)*Ryo Iikubo1,Takehisa Fujiwara1,Taro Sekikawa1,Yu Harabuchi2,Sota Satoh2,Tetsuya Taketsugu2,Yosuke Kayanuma3

Venue B  [Liquid phase]

14:50-15:084B11Spectroscopic analysis of multi-component mixtures using singular value decomposition and optimization
(Graduate School of Science, Tokyo University of Science1,Tokyo University of Science ,Pharmaceutical Department2,International University of Health and Welfare ,Pharmaceutical Department3,Otsuka Electronics Co., Ltd.4)*Yuta Tanaka1,Issei Takeuchi2,Tsubasa Iijima2,Yasuhiro Yamaki2,Hideki Kuroda4,Kimiko Makino2,Yohsuke Shimada2,Satoru Goto2,3
15:08-15:264B12Study of molecular mechanism of the antifreeze effect on an ethylene glycol aqueous solution using infrared spectroscopy and chemometrics
(ICR, Kyoto University)*Takafumi Shimoaka,Takeshi Hasegawa
15:26-15:444B13Study of ion transport through water-oil interface by using proper coordinate of interfacial structures
(Dept. Chem., Tohoku. Univ.1,ESICB, Kyoto Univ.2)*Nobuaki Kikkawa1,Lingjan Wang1,Akihiro Morita1,2

Venue C  [Biomolecules]

14:50-15:084C11Analysis of hierarchical conformational dynamics based on multi-time correlation functions and two-dimensional lifetime spectra: Application to adenylate kinase
(Institude for Molecular Science1,Graduate School of Science, Kyoto Univ.2,Graduate University for Advanced Studies3)*Junichi Ono1,Shoji Takada2,Shinji Saito1,3
15:08-15:264C12Computational Study of Copper-containing Dioxygenase and Its Biomimetic Complexes
(Graduate School of Science, Osaka Univ.)*Toru Saito,Takahiro Numata,Takashi Kawakami,Shusuke Yamanaka,Mitsutaka Okumura
15:26-15:444C13A theoretical study on methylation effect on molecular recognition
(RCAST, Univ. of Tokyo)*Takefumi Yamashita
15:44-16:024C14Theoretical molecular design of artificial nucleic acids: conductive, ferromagnetic, non-linear optical properties
(Kyushu Univ.1,JST-CREST2)*Yuuichi Orimoto1,Yuriko Aoki1,2
16:02-16:204C15Theoretical study of hydrophilicity/hydrophobicity of solute particles in a water solvent
(Inst. Sci. Eng., Kanazawa Univ.)*Kazutomo Kawaguchi,Hiroaki Saito,Hidemi Nagao

Venue E  [Theory/Calculation]

14:50-15:084E11Theoretical study on ring closure reaction of N-methoxy-N-prenylbenzamide using Hamiltonian algorithm.
(Faculty of Science, Josai University1,Faculty of Pharmaceutical Sciences, Josai University2)*Hiroyuki Teramae1,Kazuaki Komiya1,Yousuke Shimano2,Jun Takayama2,Takeshi Sakamoto2
15:08-15:264E12Propagation of Quantum Information in Nano Scale
(Toyohashi University of Technology)*Hideo Sekino
15:26-15:444E13Field induced chemical reaction and electron dynamics involved with highly degenerate excited states of boron clusters
(Graduate School of Arts and Sciences, The University of Tokyo1,Computational Materials Science Initiative (CMSI)2,Theoretical and Computational Chemistry Initiative (TCCI)3)*Takehiro Yonehara1,2,3,Kazuo Takatsuka1,2,3
15:44-16:024E14Theoretical study of the effects of spin-polarization and anchor position on single-molecular conductivity
(Graduate School of Engineering Science, Osaka University1,Graduate School of Pure and Applied Science, University of Tsukuba2,Graduate School of Science, Osaka University3)*Taku Takebayashi1,Yasutaka Kitagawa1,Yasuteru Shigeta2,Mitsutaka Okumura3,Masayoshi Nakano1
16:02-16:204E15Photo-induced electron dynamics of molecules by optical near-fields generated in a metal organic framework
(IMS)*Masashi Noda,Katsuyuki Nobusada