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.
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 |
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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 |
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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 |
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10:13-10:31 | 1A04 |
Infrared spectroscopy of large-sized neutral and protonated methanol clusters Tomohiro Kobayashi,Ryunosuke Shishido,*Asuka Fujii,Jer-Lai Kuo |
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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 |
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10:49-11:07 | 1A06 |
Millimeter and Sub-millimeter Wave Spectrum of Methylenimine *Yuta Motoki,Hiroyuki Ozeki,Kaori Kobayashi |
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11:16-11:34 | 1A07 |
EELS study on the valence excitations in CO2: Vibronic coupling effects *Tsukasa Hirayama,Noboru Watanabe,Daisuke Suzuki,Masahiko Takahashi |
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11:34-11:52 | 1A08 |
Vibronic effects on electron momentum distributions of ethylene *Noboru Watanabe,Masakazu Yamazaki,Masahiko Takahashi |
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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 |
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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 |
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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 |
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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 |
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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 |
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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 |
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11:16-11:34 | 1B07 |
Protein Dynamics of CooA upon Carbon Monoxide Dissociation *Akihiro Otomo,Haruto Ishikawa,Misao Mizuno,Shigetoshi Aono,Yasuhisa Mizutani |
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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 |
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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 |
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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 |
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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 |
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10:13-10:31 | 1C04 |
pi-Electron distribution in reduced graphene oxide *Shintaro Fujii,Toshiaki Enoki |
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10:31-10:49 | 1C05 |
STM observation of structure change on graphite surface by electrochemical oxidation *Misako Ohtsuka,Shintaro Fujii,Manabu Kiguti,Toshiaki Enoki |
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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 |
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11:16-11:34 | 1C07 |
Gradient field-induced SERS spectra of graphenes *Katsuyoshi Ikeda,Mai Takase,Kei Murakoshi |
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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 |
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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 |
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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 |
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09:46-10:04 | 1D03 |
Diffusion process of supercooled water: Temperature and pressure dependence of transition state *Tomonari Sumi,Hideo Sekino |
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10:13-10:31 | 1D04 |
New photoreaction paths of indocyanine green in condensed phase *Masanori Fuyuki,Akihide Wada |
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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 |
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10:49-11:07 | 1D06 |
Observation of molecular chirality by CARS-ROA *Kotaro Hiramatsu,Hideaki Kano,Masanari Okuno,Takashi Nagata,Hiro-o Hamaguchi |
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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 |
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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 |
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09:28-09:46 | 1E02 |
Solving the Schroedinger equation of atoms and molecules with the FC-LSE-AB method *Hiroyuki Nakashima,Hiroshi Nakatsuji |
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09:46-10:04 | 1E03 |
A Theoretical Study of Explicitly Correlated Third-order Perturbation Energy *Yu-ya Ohnishi,Seiichiro Ten-no |
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10:13-10:31 | 1E04 |
Solving Dynamic Quantum Equation by Local Basis Sets *Hideo Sekino |
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10:31-10:49 | 1E05 |
Highly accurate, numerical methods of calculation in atomic structures *Hideaki Ishikawa |
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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 |
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11:16-11:34 | 1E07 |
Development of two-component relativistic coupled-cluster method: Application to molecular ground- and excited states *Yoshinobu Akinaga,Takahito Nakajima |
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11:34-11:52 | 1E08 |
Relativistic QMC approach with spin-orbit interaction *Yutaka Nakatsuka,Takahito Nakajima |
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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 |
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13:38-13:56 | 1A11 |
Fourier transform microwave spectroscopy of CO2-DMS complex (2) *Yoshiyuki Kawashima,Eizi Hirota,Takayuki Moritani |
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13:56-14:14 | 1A12 |
Fourier transform microwave spectroscopy of CO2-DMS complex (3) *Eizi Hirota,Yoshiyuki Kawashima |
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14:23-14:59 | 1A13 |
[Invited Talk]High resolution spectroscopy of short lived species and complexes containing such species *Yasuki Endo |
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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 |
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15:26-15:44 | 1A16 |
Femtosecond laser ionization of carboxylic acid dimers Mai Amada,Tasuha Sato,Masashi Tsuge,*Kennosuke Hoshina |
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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 |
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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. |
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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 |
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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 |
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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 |
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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 |
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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 |
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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 |
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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 |
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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 |
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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 |
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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. |
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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 |
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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 |
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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 |
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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 |
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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 |
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15:26-15:44 | 1C16 |
A proposal of a novel molecular diode using a π-stacked system *Yuta Tsuji,Aleksandar Staykov,Kazunari Yoshizawa |
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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 |
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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 |
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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 |
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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 |
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13:56-14:14 | 1D12 |
Molecular dynamics calculation of spherical micelle formation *shinji kawada,mika komori,kazushi fujimoto,noriyuki yoshii,susumu okazaki |
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14:23-14:41 | 1D13 |
Multi-point correlations in glassy heterogeneous dynamica *Kang Kim,Shinji Saito,Kunimasa Miyazaki,Giulio Biroli,David Reichman |
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14:41-14:59 | 1D14 |
Theoretical study on frequency fluctuation and energy relaxation of HOH bend in liquid water *Sho Imoto,Shinji Saito |
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14:59-15:17 | 1D15 |
Application of MF-QM/MM free energy method to solution and enzyme reactions *Takeshi Yamamoto,Hiroshi Nakano |
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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 |
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15:44-16:02 | 1D17 |
Self-association of propionaldehyde and dimethylsulfoxide through “weak hydrogen bond:C-HO” 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 |
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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 |
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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 |
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13:38-14:14 | 1E11 |
[Invited Talk]Quantum many-body theories for crystals *So Hirata |
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14:23-14:41 | 1E13 |
Development of the full internally-contracted MRCI method: Joint approach with DMRG algorithm *Masaaki Saitow,Yuki Kurashige,Takeshi Yanai |
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14:41-14:59 | 1E14 |
A multiconfigurational wavefunction theory based on density matrix renormalization group *Yuki Kurashige,Takeshi Yanai |
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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 |
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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 |
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15:44-16:02 | 1E17 |
Kinetic energy functional in orbital-free density functional theory (2): Assessment on molecular systems *Yutaka Imamura,Hiromi Nakai |
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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 |
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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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