Oral Sessions on

Tuesday, September 18 (Starting at 9:10)


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.


Venue A Morning  Venue B Morning  Venue C Morning  Venue D Morning  Venue E Morning   

Venue A afternoon  Venue B afternoon  Venue C afternoon  Venue D afternoon  Venue E afternoon 

Tuesday Morning Sessions(September 18, starting at 9:10)
Venue A
[Gas phase]
09:10-09:28 1A01 Fish-Bite structure by 3-D hydrogen-bond acceptor: IR spectroscopy of pyrrole binary clusters
*Yoshiteru Matsumoto,Sunao Murakami,Kenji Honma
09:28-09:46 1A02 Structural fluctuation in the hydrated 2-Phenylethanol cluster cation revealed by gas-phase spectroscopy
*Takamasa Ikeda,Kenji Sakota,Shohei Nakata,Hiroshi Sekiya
09:46-10:04 1A03 Infrared spectroscopy of diethylether cations: Internal rotational angle dependence of the polarity of the CH bond
*Yoshiyuki Matsuda,Takahashi Kaito,Tomoya Endo,Naohiko Mikami,Asuka Fujii
10:13-10:31 1A04 Infrared spectroscopy of large-sized neutral and protonated methanol clusters
Tomohiro Kobayashi,Ryunosuke Shishido,*Asuka Fujii,Jer-Lai Kuo
10:31-10:49 1A05 Infrared spectroscopy of (CH3)3N-H+-(H2O)n , n = 1-22 : Structural analysis of neutral H-bond networks of water
*Ryunosuke Shishido,Asuka Fujii,Bing Dan,Jer-Lai Kuo
10:49-11:07 1A06 Millimeter and Sub-millimeter Wave Spectrum of Methylenimine
*Yuta Motoki,Hiroyuki Ozeki,Kaori Kobayashi
11:16-11:34 1A07 EELS study on the valence excitations in CO2: Vibronic coupling effects
*Tsukasa Hirayama,Noboru Watanabe,Daisuke Suzuki,Masahiko Takahashi
11:34-11:52 1A08 Vibronic effects on electron momentum distributions of ethylene
*Noboru Watanabe,Masakazu Yamazaki,Masahiko Takahashi
11:52-12:10 1A09 Development of time-resolved electron momentum spectroscopy: Visualization of electron motion in transient states
*Masakazu Yamazaki,Keiya Oishi,Yuji Kasai,Yuya Kawase,Masahiko Takahashi
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Venue B
[Biomolecules]
09:10-09:28 1B01 Structural identification of uric acid-melamine complex isolated in the gas phase
*Hiroya Asami,Shu-hei Urashima,Hiroyuki Saigusa
09:28-09:46 1B02 Spectroscopic and theoretical analysis of chiral molecular structure and behavior in thalidomide metabolism
*Yoshiyuki Ogino,Masahito Tanaka,Kohei Otogawa,Norio Shibata,Tetsuya Osaka,Toru Asahi
09:46-10:04 1B03 Development of Ratiometric Molecular Probe for Monitoring Oxygen Levels in Living Cells
*Toshitada Yoshihara,Yuji Yamaguchi,Masahiro Hosaka,Toshiyuki Takeuchi,Seiji Tobita
10:13-10:31 1B04 Optimization of substrates-replenishment for recursive amplification of giant vesicle-based protocell
*Kensuke Kurihara,Yumi Kan,Yusaku Okura,Kentaro Suzuki,Taro Toyota,Tadashi Sugawara
10:31-10:49 1B05 Quantitative analysis of folding dynamics of cytochrome c by two-dimensional fluorescence correlation spectroscopy
*Takuhiro Otosu,Kunihiko Ishii,Tahei Tahara
10:49-11:07 1B06 Femtosecond structural dynamics of photoactive yellow protein in the excited state
*Hikaru Kuramochi,Satoshi Takeuchi,Hironari Kamikubo,Mikio Kataoka,Tahei Tahara
11:16-11:34 1B07 Protein Dynamics of CooA upon Carbon Monoxide Dissociation
*Akihiro Otomo,Haruto Ishikawa,Misao Mizuno,Shigetoshi Aono,Yasuhisa Mizutani
11:34-11:52 1B08 The photochemical reaction dynamics of full-length of blue light sensor protein YtvA
*Seokwoo Choi,Yusuke Nakasone,Klaas Hellingwerf,Masahide Terazima
11:52-12:10 1B09 Correlation between the intermediate fluctuation and the photoreaction of BLUF proteins TePixD and SyPixD
*Kunisato Kuroi,Keisuke Tanaka,Yoshifumi Kimura,Koji Okajima,Masahiko Ikeuchi,Satoru Tokutomi,Masahide Terazima
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Venue C
[Surface]
09:10-09:28 1C01 Kondo resonance observation of a stable radical molecule of 1,3,5-triphenyl-6-oxoverdazyl (TOV) adsorbed on Au(111)
*Jie Liu,Hironari Isshiki,Keiichi Katoh,Masahiro Yamashita,Tadahiro Komeda
09:28-09:46 1C02 A study of electronic state of nylon at the extreme surface by using attenuated total reflection spectroscopy in far ultraviolet region
*Manaka Yasunaga,Yusuke Morisawa,Harumi Sato,Masahiro Ehara,Akifumi Ikehata,Noboru Higashi,Yukihiro Ozaki
09:46-10:04 1C03 Structural analysis of n-alkane thin films grown on the Pt(111) surface modified with the monolayer graphene
*Osamu Endo,Masashi Nakamura,Kenta Amemiya,Hiroyuki Ozaki
10:13-10:31 1C04 pi-Electron distribution in reduced graphene oxide
*Shintaro Fujii,Toshiaki Enoki
10:31-10:49 1C05 STM observation of structure change on graphite surface by electrochemical oxidation
*Misako Ohtsuka,Shintaro Fujii,Manabu Kiguti,Toshiaki Enoki
10:49-11:07 1C06 The interaction between the image potential state and the unoccupied molecular orbital of rubrene on graphite
*Takahiro UEBA,Rie TERAWAKI,Takanori MORIKAWA,Yasutaka KITAGAWA,Mitsutaka OKUMURA,Takashi YAMADA,Hiroyuki KATO,Toshiaki MUNAKATA
11:16-11:34 1C07 Gradient field-induced SERS spectra of graphenes
*Katsuyoshi Ikeda,Mai Takase,Kei Murakoshi
11:34-11:52 1C08 Three-dimensional single molecule tracking of fluorescent guest dyes in polymer thin films
*Syoji Ito,Yuhei Taga,Satoshi Takei,Hiroshi Miyasaka
11:52-12:10 1C09 Chiral vibrational SFG spectroscopy with a liquid-crystal variable retarder
*Taka-aki Ishibashi,Kazuy Miyoshi
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Venue D
[Liquid phase]
09:10-09:28 1D01 A study of electronic state of alkanes in the condensed state by using attenuated total reflection spectroscopy and quantum chemical calculation
Yusuke Morisawa,Shin Tachibana,Manaka Yasunaga,Masahiro Ehara,Akifumi Ikehata,Noboru Higashi,*Yukihiro Ozaki
09:28-09:46 1D02 Phase separation dynamics of aqueous thermoresponsive polymer solutions studied by single-molecule fluorescence spectroscopy
*Takanori Tada,Yukiteru Katsumoto,Johan Hofkens,Hiroshi Uji-i,Karel Goossens,Tatsuya Shoji,Noboru Kitamura,Yasuyuki Tsuboi
09:46-10:04 1D03 Diffusion process of supercooled water: Temperature and pressure dependence of transition state
*Tomonari Sumi,Hideo Sekino
10:13-10:31 1D04 New photoreaction paths of indocyanine green in condensed phase
*Masanori Fuyuki,Akihide Wada
10:31-10:49 1D05 Trial to Observe Wavepacket Motions near the Potential “Funnel” in Stilbene Photoisomerization by Pump-dump-probe Spectroscopy
*Zhengrong Wei,Satoshi Takeuchi,Tahei Tahara
10:49-11:07 1D06 Observation of molecular chirality by CARS-ROA
*Kotaro Hiramatsu,Hideaki Kano,Masanari Okuno,Takashi Nagata,Hiro-o Hamaguchi
11:16-11:34 1D07 Dynamics of Oil Droplets in the Presence of Gemini-type Cationic Surfactants
*Taisuke Banno,Shingo Miura,Rie Kuroha,Taro Toyota
11:34-12:10 1D08 [Invited Talk]Raman spectroscopic applications: from physics to biology and medicine
*Siva Umapathy
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Venue E
[Theory/calculation]
09:10-09:28 1E01 Accurate Solution of the Schroedinger Equation: Extension to Time-Dependent System
*Hiroshi Nakatsuji,Hiroyuki Nakashima
09:28-09:46 1E02 Solving the Schroedinger equation of atoms and molecules with the FC-LSE-AB method
*Hiroyuki Nakashima,Hiroshi Nakatsuji
09:46-10:04 1E03 A Theoretical Study of Explicitly Correlated Third-order Perturbation Energy
*Yu-ya Ohnishi,Seiichiro Ten-no
10:13-10:31 1E04 Solving Dynamic Quantum Equation by Local Basis Sets
*Hideo Sekino
10:31-10:49 1E05 Highly accurate, numerical methods of calculation in atomic structures
*Hideaki Ishikawa
10:49-11:07 1E06 Application of the four component relativistic MP2-F12 method to He-like atoms and AuH
*Daisuke Yamaki,Seiichiro Ten-no
11:16-11:34 1E07 Development of two-component relativistic coupled-cluster method: Application to molecular ground- and excited states
*Yoshinobu Akinaga,Takahito Nakajima
11:34-11:52 1E08 Relativistic QMC approach with spin-orbit interaction
*Yutaka Nakatsuka,Takahito Nakajima
11:52-12:10 1E09 On the problems of the spin density approximation for the calculations of the spin-spin dipolar term of zero-field splitting tensors
*Kenji Sugisaki,Kazuo Toyota,Kazunobu Sato,Daisuke Shiomi,Masahiro Kitagawa,Takeji Takui
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Tuesday Afternoon Sessions(September 18, starting at 13:20)
Venue A
[Gas phase]
13:20-13:38 1A10 The Fourier-transform microwave spectroscopy of N-methylacetamide CCD3 and N-D deuterated species
*Takayuki Fujitani,Yuusuke Satou,Toshihiro Tanaka,Keiko Kanda,Masaharu Fujitake
13:38-13:56 1A11 Fourier transform microwave spectroscopy of CO2-DMS complex (2)
*Yoshiyuki Kawashima,Eizi Hirota,Takayuki Moritani
13:56-14:14 1A12 Fourier transform microwave spectroscopy of CO2-DMS complex (3)
*Eizi Hirota,Yoshiyuki Kawashima
14:23-14:59 1A13 [Invited Talk]High resolution spectroscopy of short lived species and complexes containing such species
*Yasuki Endo
14:59-15:17 1A15 Microwave spectroscopic study on methyl formate E-sublevel in the second torsional excited state
*Kaori Kobayashi,Yusuke Sakai,Kazunori Takamura,Shozo Tsunekawa,Nobukimi Ohashi
15:26-15:44 1A16 Femtosecond laser ionization of carboxylic acid dimers
Mai Amada,Tasuha Sato,Masashi Tsuge,*Kennosuke Hoshina
15:44-16:02 1A17 Stabilization of the Higher Energy Conformer of Formic Acid upon Complex Formation with a Carbon Dioxide Molecule
*Masashi Tsuge,Kseniya Marushkevich,Markku Rasanen,Leonid Khriachtchev
16:02-16:20 1A18 Structures and dynamics of molecule-(H2O)n complex anions
*Ryuzo Nakanishi,Takashi Nagata,Voora V.K.,Jordan K.D.,Breen K.J.,DeBlase A.F.,Guasco T.L.,Johnson M.A.
16:20-16:38 1A19 Millimeter wave spectroscopy of the (ortho)hydrogen-water complex: Observation of the rotational spectrum in the internal rotation excited state of (ortho)hydrogen
*Yukiya Iwasaki,Kensuke Harada,Keiichi Tanaka
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Venue B
[Biomolecules]
13:20-13:38 1B10 A reactive molecular dynamics study of proton pumping function of a protein
*Takefumi Yamashita,Gregory A. Voth
13:38-13:56 1B11 Photoinduced crystallization of protein with strong photon coupling field
*Tetsuo Okutsu,Susumu Haruta,Takao Yamashita,Hiroka Imai,Takuma Tomaru,Hiroaki Horouchi
13:56-14:14 1B12 Influence of Solute Surface Property on the Spatial Distribution of Protein Transfer Free Energy: A Case of the Molecular Crowding Condition with Osmolyte
*Isseki Yu,Kyoko Nakada,Masataka Nagaoka
14:23-14:41 1B13 QM and NMR Approach to Proton Transfer in Hydrogen-bonding Network of Active Site in Carbonic Anhydrase
*Hideto Shimahara,Kimikazu Sugimori,Koyimatu Muhamad,Hidemi Nagao,Tadayasu Ohkubo,Yuji Kobayashi
14:41-14:59 1B14 Free energy analysis of ATP hydrolysis reaction by QM/MM method combined with a theory of solutions
*Hideaki Takahashi,Akihiro Morita
14:59-15:17 1B15 Mechanism of Glycerol Dehydration by Dio Dehydratase from Combined QM/MM Calculations
*Kazuki Doitomi,Takashi Kamachi,Tetsuo Toraya,Kazunari Yoshizawa
15:26-15:44 1B16 High-efficient DNA electronic structure analysis by ab initio elongation method
*Yuuichi Orimoto,Peng Xie,Kai Liu,Feng Long Gu,Yuriko Aoki
15:44-16:02 1B17 Theoretical study on hydrated DNA systems with unnatural base pair by quantum chemical and linear-scaling DFT calculaions
*Takao Otsuka,Michiaki Arita,David Bowler,Tsuyoshi Miyazaki
16:02-16:20 1B18 Mutational effects on the reaction of Nylon oligomer Hydrolase
*Takeshi Baba,Katsumasa Kamiya,Toru Matsui,Katsuki Okuno,Boero Mauro,Seiji Negoro,Masayoshi Nakano,Yasuteru Shigeta
16:20-16:38 1B19 Theoretical Investigation of Solvent Effects on Glycosylation Reactions: Stereoselectivity Controlled by Preferential Conformations of the Intermediate Oxacarbenium-Counterion Complex
*Hiroko Satoh,Halvor Hansen,Shino Manabe,Wilfred van Gunsteren,Philippe Huenenberger
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Venue C
[Solid phase]
13:20-13:38 1C10 Synthesis and Anomalous Transport Properties of (DIETSe)2FeBr4xCl4(1-x)
*Genta Kawaguchi,Mitsuhiko Maesato,Hiroshi Kitagawa,Tatsuro Imakubo,Graf David,Kiswandhi Andhika,Brooks James S.
13:38-13:56 1C11 Control of Dimerization Gap and Triangular Lattice in Conducting Platinum-dmit Salts
*Mitsushiro Nomura,Takao Tsumuraya,Majed Abdel Jawad,Hengbo Cui,Tsuyoshi Miyazaki,Reizo Kato
13:56-14:14 1C12 Quantum spin liquid state induced by control of frustration parameter in triangular lattice; Magnetic state of Et2Me2AsxSb1-x [Pd(dmit) 2]2 mixed crystals
*kouhei Ueda,Hengbo CUI,Satoshi Yamashita,Takeo Fukunaga,Hiroshi Yamamoto,Reizo Kato
14:23-14:41 1C13 Synthesis, structures and physical properties of selenium-containing BDT-TTP derivatives with methoxy groups
*Takashi Shirahata,Naoya Murakami,Shinya Toki,Tetsuya Ito,Yohji Misaki
14:41-14:59 1C14 Uniaxial Strain Orientation Dependence of Superconducting Transition Temperature ( T c ) and Critical Superconducting Pressure ( P c ) in β-(BDA-TTP)2I3
*Haruo Yoshimoto,Koichi Kikuchi,Junichi Yamada,Wataru Fujita,Takeshi Kodama
14:59-15:17 1C15 Crystal structure and physical properties of the organic conductor (BTBT)2PF6
*Tomofumi Kadoya,Minoru Ashizawa,Shouhei Kumeta,Tadashi Kawamoto,Hidetoshi Matsumoto,Takehiko Mori
15:26-15:44 1C16 A proposal of a novel molecular diode using a π-stacked system
*Yuta Tsuji,Aleksandar Staykov,Kazunari Yoshizawa
15:44-16:02 1C17 Observation of a two-dimensional spin diffusion in ESR study of the single crystal of a purely-organic magnetic metal, κ-β’’-(BEDT- TTF)2(PO-CONHC2H4SO3)
*Hiroki akutsu,Akane Akutsu-Sato,Jun-ichi Yamada,Shin'ichi Nakatsuji
16:02-16:20 1C18 Structural and physical properties of C(CN)3 salt of EDO-TTF, and its mono-substituted derivatives
*Manabu Ishikawa,Yoshiaki Nakano,Mikio Uruichi,Kyuya Yakushi,Hideki Yamochi
16:20-16:38 1C19 Phase Transition Behavior of Organic Alloy, [(EDO-TTF)1-x(CLEDO-TTF)x]2PF6
*Tomoyuki Haraguchi,Manabu Ishikawa,Hideki Yamochi
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Venue D
[Liquid phase]
13:20-13:38 1D10 Effect of Time Scales on Energy Landscape in Condensed Phase Dynamics
*Shinnosuke Kawai,Tamiki Komatsuzaki
13:38-13:56 1D11 Free energy of transfer of polar molecules from water phase to the micelle by molecular dynamics calculations
*Kazushi Fujimoto,Noriyuki Yoshii,Susumu Okazaki
13:56-14:14 1D12 Molecular dynamics calculation of spherical micelle formation
*shinji kawada,mika komori,kazushi fujimoto,noriyuki yoshii,susumu okazaki
14:23-14:41 1D13 Multi-point correlations in glassy heterogeneous dynamica
*Kang Kim,Shinji Saito,Kunimasa Miyazaki,Giulio Biroli,David Reichman
14:41-14:59 1D14 Theoretical study on frequency fluctuation and energy relaxation of HOH bend in liquid water
*Sho Imoto,Shinji Saito
14:59-15:17 1D15 Application of MF-QM/MM free energy method to solution and enzyme reactions
*Takeshi Yamamoto,Hiroshi Nakano
15:26-15:44 1D16 Time-resolved infrared spectroscopy of a singlet cyclopentane-1,3-diyl with carbonyl groups
*Shin Seyama,Megumi Mishima,Akihiro Maeda,Manabu Abe,Taka-aki Ishibashi
15:44-16:02 1D17 Self-association of propionaldehyde and dimethylsulfoxide through “weak hydrogen bond:C-HO” probed by IR and THz-TD spectroscopies and DFT calculations
*Kazuko Mizuno,Takuya Kikuchi,Kousuke Murakami,Hajime Nagaoka,Yuuki Aoike,Kohji Yamamoto,Masahiko Tani,Kazutosi Fukui
16:02-16:20 1D18 Simultaneous measurement of near-IR resonance inverse Raman and double-resonance two-photon spectra of beta-carotene in excited singlet states
*Tomohisa Takaya,Koichi Iwata
16:20-16:38 1D19 Vibrational Coherent Control of Metal Di-Carbonyl using Shaped Mid-IR Pulses
*Jumpei Tayama,Kaori Enomoto,Satoshi Ashihara
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Venue E
[Theory/calculation]
13:20-13:38 1E10 Sapporo basis set : Relativistic basis sets with core-valence correlation effects for the 6-th period s, p, and d-block atoms
*Takeshi Noro,Masahiro Sekiya,Toshikatsu Koga
13:38-14:14 1E11 [Invited Talk]Quantum many-body theories for crystals
*So Hirata
14:23-14:41 1E13 Development of the full internally-contracted MRCI method: Joint approach with DMRG algorithm
*Masaaki Saitow,Yuki Kurashige,Takeshi Yanai
14:41-14:59 1E14 A multiconfigurational wavefunction theory based on density matrix renormalization group
*Yuki Kurashige,Takeshi Yanai
14:59-15:17 1E15 Tree Tensor Network States Algorithm in Quantum Chemistry: A D-dimensional Generalization of DMRG
*Naoki Nakatani,K.-L. Chan Garnet
15:26-15:44 1E16 Development of elongation optimization method and local vibrational analysis
*Yuriko Aoki,Kai Liu,Yun-an Yan,Yuuichi Orimoto,Feng Long Gu
15:44-16:02 1E17 Kinetic energy functional in orbital-free density functional theory (2): Assessment on molecular systems
*Yutaka Imamura,Hiromi Nakai
16:02-16:20 1E18 Development of Divide-and-Conquer based Linear-Scaling Method for Non-Local Excited States
*Hiromi Nakai,Takeshi Yoshikawa,Yutaro Nonaka
16:20-16:38 1E19 Academic evaluation of quantum chemistry literature data base
*Shinichi Yamabe,Haruo Hosoya,Toshio Matsushita,Umpei Nagashima,Keiko Takano,Nobuaki Koga,Masahiko Hada,Hidenori Matsuzawa,Kenrou Hashimoto,Hiroaki Wasada,Masanori Tachikawa,Takeshi Nishikawa,Yasuteru Shigeta,Hirotoshi Mori
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