Sunday, September 21 (Starting at 9:18)
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.
Venue A MorningVenue B MorningVenue C MorningVenue D MorningVenue E Morning
Venue A afternoonVenue B afternoonVenue C afternoonVenue D afternoonVenue E afternoon
Venue A afternoonVenue B afternoonVenue C afternoonVenue D afternoonVenue E afternoon
Sunday Morning Sessions(September 21, starting at 9:18)
| 9:18-9:36 | 1A01 | Relationship between conformational structure and methyl internal rotation potential barriers in N-methylacetamide-water complexes (Graduate School of Natural Science & Technology, Kanazawa Univ.)*Yuuki Nakanishi,Norie Koi,Masaharu Fujitake |
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| 9:36-9:54 | 1A02 | Intramolecular rotation in methylchalcogeno benzene analogues (Univ. of Electro-Communications)*Yoshihiro Yamakita,Shota Shimokawara,Noriaki Kobayashi |
| 9:54-10:12 | 1A03 | Conformational analysis of whisky lactone using Fourier transform microwave spectroscopy and quantum chemical calculations (2) (Kanagawa Inst Tech1,Grad. Univ. Adv. Studies2)*Yoshiyuki Kawashima1,Jun Utsugi1,Ryusuke Katsuragi1,Eizi Hirota2 |
| 10:12-10:30 | 1A04 | Fourier-transform microwave spectroscopy of Rg-CS complexes (Graduate School of Arts and Sciences,The University of Tokyo)*Mizuki Kurihara,Masakazu Nakajima,Yasuki Endo |
| 10:30-10:48 | 1A05 | FTIR spectroscopy of the NO3 n3+2n4 band (Graduate School of Natural Science, Okayama Univ.1,STE, Nagoya Univ.2,Graduate School of Information Sciene, Hiroshima City Univ.3)*Kentarou Kawaguchi1,Tatsuo Narahara1,Ryuji Fujimori2,Jian Tang1,Takashi Ishiwata3 |
| 10:48-11:24 | 1A06 | [Invited Talk]Recent progress in experimental studies of chemical reaction dynamics (Department of Chemistry, Kyoto University)*Toshinori Suzuki |
| 11:24-11:42 | 1A08 | High-resolution laser spectroscopy of the B - X transition of 15NO3 radical (Graduate School of Science, Kobe Univ.1,Faculty of Science, Kobe Univ.2,Molecular Photoscience Research Center, Kobe Univ.3,Graduate School of Information Sciences, Hiroshima City Univ.4,The Graduate Univ. for Advanced Studies5)*Kohei Tada1,Kanon Teramoto2,Hitomi Matsubara2,Shunji Kasahara3,Takashi Ishiwata4,Eizi Hirota5 |
| 11:42-12:00 | 1A09 | High-resolution laser spectroscopy of the B-X transition of 14 NO3 radical (Molecular Photoscience Research Center, Kobe Univ.1,Graduate School of Science, Kobe Univ.2,Faculty of Science, Kobe Univ.3,Graduate School of Information Sciences, Hiroshima City Univ.4,The Graduate Univ. for Advanced Studies5)*Shunji Kasahara1,Kohei Tada2,Tsuyoshi Takashino3,Takashi Ishiwata4,Eizi Hirota5 |
| 9:18-9:36 | 1B01 | The methylene chain length dependence of singlet oxygen lifetime in ionic liquids (Tokyo Tech1,Hyderabad Univ.2)*Tsuyoshi Yoshida1,Akio Kawai1,Dinesh Khara2,Anunay Samanta2 |
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| 9:36-9:54 | 1B02 | Variation of hydrogen-bonding network of water upon the dissolution of electrolyte studied by near-infrared spectroscopy (Graduate School of Agriculture, TUAT1,UGAS, TUAT2)*Naruya Uchida1,Norio Yoshimura2,Masao Takayanagi2 |
| 9:54-10:12 | 1B03 | A molecular explanation of hydrophobic hydration in terms of weak hydrogen bonds C–H•••OH2 (Graduate School of Engineering, Univ. of Fukui1,Faculty of Medical Sciences, Univ. of Fukui,2)*Kazuko Mizuno1,Takashi Sumikama2,Yoshinori Tamai1 |
| 10:12-10:30 | 1B04 | Theoretical study of water dimer predissociation (Inst. of atomic and molecular science1,Chiao Tung Univ.2)*Hirobumi Mineo1,Yuichi Fujimura2 |
| 10:30-10:48 | 1B05 | Ultrafast vibrational dynamics of water disentangled by reverse non-equilibrium ab initio molecular dynamics simulations (Graduate School of Science, Kyoto Univ.1,Max Plank Institute for Polymer Research2)*Seiji Yoshimune1,2,Mischa Bonn2,Yuki Nagata2 |
| 10:48-11:06 | 1B06 | Macromolecular crowding effect on adsorption of anions onto thermoresponsive polymer: its influence on the random coil-globule transition (Kyushu University)*Kenji Sakota,Daiki Tabata,Hiroshi Sekiya |
| 11:06-11:24 | 1B07 | A solution ESR study of anion radical of a naphthalene diimide derivative (Graduate School of Science, Osaka City Univ.)*Kazunobu Sato,Tohru Araki,Shuichi Suzuki,Kazuo Toyota,Daisuke Shiomi,Keiji Okada,Takeji Takui |
| 11:24-11:42 | 1B08 | Application of particle-mesh Ewald summation to ONIOM theory (Faculty of Science and Technology of Sophia University)*Osamu Kobayashi,Sebastian Danielache,Shinkoh Nanbu |
| 11:42-12:00 | 1B09 | Theoretical study of photoisomerization reaction between 1,3-cyclohexadiene and 1,3,5-cis-hexatriene in liquid phase (Fac. Sci. and Tech., Sophia Univ.1,Individual2)*Ayumi Ohta1,Osamu Kobayashi1,Toshimasa Ishida2,Shinkoh Nanbu1 |
Venue C [Clusters/Particles/Nanostructures]
| 9:18-9:36 | 1C01 | Control of the emission behavior from a single quantum dot by a silver-coated AFM tip (Department of Chemistry, Kwansei Gakuin Univ.)*Sadahiro Masuo,Hiroki Takata |
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| 9:36-9:54 | 1C02 | Spatio-temporal observation of plasmon-wave dynamics 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 |
| 9:54-10:12 | 1C03 | Changes in local optical activity induced by increasing chirality of metallic nanostructures (Inst. Mol. Sci.1,The Graduate Univ. for Advanced Studies2)*Tetsuya Narushima1,2,Shun Hashiyada1,2,Hiromi Okamoto1,2 |
| 10:12-10:48 | 1C04 | [Invited Talk]Nano-optical imaging of plasmonic materials (Inst. Mol. Sci.)*Hiromi Okamoto |
| 10:48-11:06 | 1C06 | Microscopic structure of Au nanoparticles synthesized in ionic liquids (College of Humanities and Sciences , Nihon Univ.1,Catalysis Research Center, Hokkaido Univ.2,Graduate School of Advanced Integration Science, Chiba Univ.3)*Yoshikiyo Hatakeyama1,Kiyotaka Asakura2,Ken Judai1,Keiko Nishikawa3 |
| 11:06-11:24 | 1C07 | Regenerative synthesis of copper nanoparticles by photoreduction and their catalytic activity (Faculty of Science and Engineering, Chuo University)*Hideki Tanaka,Takuya Aoki,Naoki Nishida |
| 11:24-11:42 | 1C08 | Fabrication of Rh nanoframeworks by Au nanorods dissolution (Graduate School of Engineering Sciences, Kyushu Univ1,Institute for Materials Chemistry and Engineering, Kyushu Univ2)*Yukinori Nakashima1,Masashi Hattori2,Masaharu Tsuji2 |
| 11:42-12:00 | 1C09 | Au ultrathin nanorods: synthesis and evaluation of optical properties and stability (School of Science, The University of Tokyo1,ESICB, Kyoto Univ.2)*Ryo Takahata1,Seiji Yamazoe1,2,Kiichirou Koyasu1,2,Tatsuya Tsukuda1,2 |
| 9:18-9:36 | 1D01 | Water Structure at the “Buried” Silica Interface Studied with Heterodyne Detected Vibrational Sum-Frequency Generation (Molecular Spectroscopy Laboratory, RIKEN1,Ultrafast Spectroscopy Research Team, RIKEN Center for Advanced Photonics2,Department of Applied Chemistry, Faculty of Engineering, Saitama University3)*Anton Myalitsin1,Shuhei Urashima1,Satoshi Nihonyanagi1,2,Shoichi Yamaguchi3,Tahei Tahara1,2 |
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| 9:36-9:54 | 1D02 | Ultrafast vibrational dynamics at air/water interface with free-OH excitation using time-resolved HD-VSFG (Molecular Spectroscopy Laboratory, RIKEN1,Ultrafast Spectroscopy Research Team, RIKEN Center for Advanced Photonics (RAP)2)*Ken-ichi Inoue1,Prashant Singh1,Satoshi Nihonyanagi1,2,Shoichi Yamaguchi1,2,Tahei Tahara1,2 |
| 9:54-10:12 | 1D03 | Investigation of intermolecular structure of confined binary mixture water and ethanol by XRD and ND (Shinshu University1,KEK2)*Masatsugu Yoshimoto1,Taku Iiyama1,Hiroyuki Makino1,Atom Hamasaki1,Sumio Ozeki1,Toshiya Otomo2 |
| 10:12-10:30 | 1D04 | Size-dependent water structure in carbon nanotubes (Graduate School of Science, Chiba Univ.)*Tomonori Ohba |
| 10:30-10:48 | 1D05 | Structural Characterization of the Unsaturated Phospholipid Monolayers Exposed to Low-level Ozone (CRC, Hokkaido Univ.)*Lin Qiao,Masatoshi Osawa,Shen Ye |
| 10:48-11:06 | 1D06 | Molecular dynamics analysis of organic solvent interface and nonlinear spectroscopy in relation to batteries (Elements Strategy Initiative for Catalysts and Batteries (ESICB), Kyoto University1,Department of Chemistry, Graduate School of Science, Tohoku University2,Catalysis Research Center, Hokkaido University3)*Lin Wang1,2,Qiling Peng3,Shen Ye3,Akihiro Morita1,2 |
| 11:06-11:24 | 1D07 | Heterodyne-detected chiral vibrational sum frequency generation spectroscopy (Graduate School of Pure and Applied Sciences, University of Tsukuba)*Masanari Okuno,Taka-aki Ishibashi |
| 11:24-12:00 | 1D08 | [Invited Talk]Development and application of new interface-selective nonlinear spectroscopy (Molecular Spectroscopy Laboratory, RIKEN1,RIKEN Center for Advanced Photonics2)*Tahei Tahara1,2 |
| 9:18-9:36 | 1E01 | 3D-RISM-SCF analysis of substituent effects on the absorption spectra of Brooker’s merocyanine (Graduate School of Sciences, Kyushu Univ.)*Yuichi Tanaka,Norio Yoshida,Haruyuki Nakano |
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| 9:36-9:54 | 1E02 | Theory and efficient computation of differential vibrational spectra (Graduate School of Science, Tohoku University1,ESICB, Kyoto University2)Suguru Sakaguchi1,*Tatsuya Joutsuka1,Akihiro Morita1,2 |
| 9:54-10:12 | 1E03 | Computational mutation analysis for enzymatic reaction (IMCE, Kyushu Univ.1,Okayama Univ.2)*Kazuki Doitomi1,Takashi Kamachi1,Tetsuo Toraya2,Kazunari Yoshizawa1 |
| 10:12-10:30 | 1E04 | A molecular dynamics study on the free energy profile of antigen-antibody dissociation process (RCAST, Univ. of Tokyo)*Takefumi Yamashita |
| 10:30-10:48 | 1E05 | A theoretical study on the fluorescence spectrum of enhanced green fluorescent protein (Graduate School of Science, Kyoto Univ.1,Faculty of Science, Univ. of Ryukyus2)*Yoshihiro Uchida1,Masahiro Higashi2,Shigehiko Hayashi1 |
| 10:48-11:06 | 1E06 | Development of ab initio semiclassical MD method (IMS,National Chiao Tung University1,Faculty of Science and Engineering, Sophia University2,Inst. of Physics, National Chiao Tung University3)*Hiroki Nakamura1,Shinkoh Nanbu2,Yoshiaki Teranishi3 |
| 11:06-11:24 | 1E07 | Chiral Structure and Circular Dichroism Spectra: ChiraSac Study (QCRI)*Tomoo Miyahara,Hiroshi Nakatsuji |
| 11:24-11:42 | 1E08 | Conformational analysis of polypeptide with replica-exchange molecular dynamics method and anharmonic vibrational structure calculation (Theoretical Molecular Science Lab., RIKEN1,Chemical Resources Lab., Tokyo Institute of Technology2)*Hiroki Otaki1,Kiyoshi Yagi1,Yuji Sugita1,Shun-ichi Ishiuchi2,Masaaki Fujii2 |
| 11:42-12:00 | 1E09 | Theoretical studies on redox potential of blue cupper proteins by MD and QM/MM calculations. II (Graduate School of Natural Science and Technology, Kanazawa University1,Research Center for Higher Education, Kanazawa University2)*Masashi Iwayama1,Hiroaki Saito1,Kimikazu Sugimori2,Kazutomo Kawaguchi1,Hidemi Nagao1 |
Sunday Afternoon Sessions(September 21, starting at 13:20)
| 13:20-13:38 | 1A10 | A new trend in the study of vibronic interaction in a symmetric-top free radical (Grad. Univ. Advanced Studies1,Hiroshima City Univ.2)*Eizi Hirota1,Masaru Fukushima2 |
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| 13:38-13:56 | 1A11 | Four-wave mixing spectra of the NO3 B 2E' - X 2A2' system (Graduate School of Information Sciences, Hiroshima City Univ.)*Masaru Fukushima,Takashi Ishiwata |
| 13:56-14:14 | 1A12 | Generation and observation of vibrational wavepacket in nitrogen molecule by high harmonic pulses (RIKEN, RAP1,Univ. of Tokyo2)*Tomoya Okino1,Yusuke Furukawa1,Eilanlou Amani1,Yasuo Nabekawa1,Eiji Takahashi1,Kaoru Yamanouchi2,Katsumi Midorikawa1 |
| 14:14-14:32 | 1A13 | Development of ultrafast photoelectron diffraction (High Energy Accelerator Research Organization1,College of Science and Engineering, Ritsumeikan University2,Japan Atomic Energy Agency3,Graduate School of Engineering, Kyoto University4,Graduate School of Science, The University of Tokyo5)*Kyo Nakajima1,Takahiro Teramoto2,Hiroshi Akagi3,Takuya Majima4,Shinichiro Minemoto5,Ken Wada1,Akira Yagishita1 |
| 14:32-14:50 | 1A14 | High harmonics time-resolved spectroscopy to observe vibrational wavepacket motion of H2+ (RIKEN, RAP1,Univ. Tokyo2)*Yusuke Furukawa1,Tomoya Okino1,Eilanlou Amani1,Yasuo Nabekawa1,Eiji Takahashi1,Kaoru Yamanouchi2,Katsumi Midorikawa1 |
| 14:50-15:08 | 1A15 | Probing the real time the plasmon resonance heating in the nanoplasma produced by XFEL irradiation at SACLA (IMRAM, Tohoku Univ.1,RIKEN SPring-8 Center2,Department of Physics, Kyoto Univ.3,Department of Physics Science, Hiroshima Univ.4,Synchrotron SOLEIL5,JASRI6,CFEL, DESY7,Hamberg Center fot Ultrafast Imaging CUI8,Institute of Nuclear Physics, PAS9,Department of Physics, Univ. of Hamburg10)*Yoshiaki Kumagai1,Weiqing Xu1,Hironobu Fukuzawa1,2,Kouji Motomura1,Kiyonobu Nagaya2,3,Shinich Wada2,4,Subhendu Mondal1,Tethuya Tachibana1,Yuta Ito1,Tsukasa Sakai3,Kenji Matsunami3,Toshiyuki Nishiyama3,Takayuki Umemoto4,Christophe Nicolas5,Catalin Miron5,Tadashi Togashi6,Kanade Ogawa2,Shigeki Owada2,Kensuke Tono6,Makina Yabashi2,Zoltan Jurek7,8,Sang-kil Son7,Beata Ziaja7,8,9,Makoto Yao3,Robin Santra7,8,10,Kiyoshi Ueda1,2 |
| 15:08-15:26 | 1A16 | Development of a method to observe EELS cross sections in molecular frame (IMRAM, Tohoku Univ.)*Noboru Watanabe,So Yamada,Tsukasa Hirayama,Atsushi Seki,Daisuke Suzuki,Masahiko Takahashi |
| 15:26-15:44 | 1A17 | Ultrafast responses of an electron distribution in Xe to intense laser fields by laser-assisted electron scattering (School of Science, the University of Tokyo)*Yuya Morimoto,Reika Kanya,Kaoru Yamanouchi |
| 15:44-16:02 | 1A18 | Real-time observation of molecular rotational wavepacket dynamics using a newly developed ion imaging apparatus (IMS, SOKENDAI)*Kenta Mizuse,Yasuhiro Ohshima |
| 16:02-16:20 | 1A19 | Excited-state dynamics of pyrazine studied with an ultrashort pulse at 130 nm (Graduate School of Science, Kyoto Univ.)*Takuya Horio,Roman Spesyvtsev,Toshinori Suzuki |
| 13:20-13:38 | 1B10 | Flexibility of mesogenic molecules and aggregation structure of liquid crystals (Dept. Chem., Univ. Tsukuba)*Kazuya Saito,Yasuhisa Yamamura,Mafumi Hishida |
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| 13:38-13:56 | 1B11 | Sacrificial anion reduction mechanism for electrochemical stability improvement in highly concentrated Li-salt electrolyte (ESICB, Kyoto Univ.1,MANA, NIMS2,School of Engineering, The Univ. of Tokyo3,Graduate School of Pure and Applied Science, Univ. of Tsukuba4,JST PRESTO and CREST5)*Keitaro Sodeyama1,2,Yuki Yamada1,3,Koharu Aikawa2,4,Atsuo Yamada1,3,Yoshitaka Tateyama1,2,5 |
| 13:56-14:14 | 1B12 | Coexistence of a liquid and a mesophase in ionic liquid (C8mim)BF4 (Faculty of Science, Fukuoka Univ.)*Keisuke Watanabe,Tomomi Komai,Keishi Negita |
| 14:14-14:32 | 1B13 | Nuclear Quantum Effects in Liquid para-Hydrogen (Department of Chemistry, Kyoto University1,PRESTO2)*Hyeon-deuk Kim1,2 |
| 14:32-14:50 | 1B14 | Mono-dispersed Nitroxide Radical Liquid Microcapsules (Graduate School of Engineering Science, Osaka University1,JST PRESTO2,Graduate School of Human and Environmental Studies, Kyoto University3,Institute for Chemical Research, Kyoto University4)*Yoshiaki Uchida1,2,Yosuke Iwai1,Takuya Akita1,Takahito Mitome1,Katsuaki Suzuki4,Rui Tamura3,Norikazu Nishiyama1 |
| 14:50-15:08 | 1B15 | On the Branching Ratio of Photoisomerization of 4-Aminoazobenzene (MPRC, Kobe Univ.)*Neeraj Joshi,Masanori Fuyuki,Akihide Wada |
| 15:08-15:26 | 1B16 | Energy landscapes in the multi-dimensional system and extraction of hidden dynamical modes (Graduate School of Science, Shizuoka Univ.)*Shinnosuke Kawai |
Venue C [Clusters/Particles/Nanostructures]
| 13:20-13:38 | 1C10 | Activation of carbon dioxide by cobalt cluster anions in the gas phase (Graduate School of Science, The Univ. of Tokyo1,ESICB, Kyoto Univ.2)*Akimaro Yanagimachi1,Kiichirou Koyasu1,2,Tatsuya Tsukuda1,2 |
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| 13:38-13:56 | 1C11 | A new structure model for magic cluster Al23–: face-sharing bi-icosahedral motif (The Univ. of Tokyo1,ESICB, Kyoto Univ.2)*Kiichirou Koyasu1,2,Tatsuya Tsukuda1,2 |
| 13:56-14:14 | 1C12 | Softening of Au–Au bonds in gold clusters by size reduction (School of Science, The Univ. of Tokyo1,ESCIB, Kyoto Univ.2,Faculty of Science, Tokyo Univ. of Science3)*Seiji Yamazoe1,2,Shinjiro Takano1,Wataru Kurashige3,Yuichi Negishi3,Tatsuya Tsukuda1,2 |
| 14:14-14:32 | 1C13 | Effect of charge transfer from PVP on stability and reactivity of Al13 superatom (School of Science, The Univ. of Tokyo1,ESICB, Kyoto Univ.2)*Tomomi Watanabe1,2,Kiichirou Koyasu1,2,Tatsuya Tsukuda1,2 |
| 14:32-14:50 | 1C14 | Interfacial structure of chalcogenate-protected Au25 clusters (Tokyo Univ. of Sci.1,The Univ. of Tokyo2,Tokyo Univ. of Sci.3,IMS4)*Wataru Kurashige1,Seiji Yamazoe2,Masaki Yamaguchi3,Keisuke Nishido3,Katsuyuki Nobusada4,Tatsuya Tsukuda2,Yuichi Negishi1,3 |
| 14:50-15:08 | 1C15 | Activation of water-splitting photocatalysts by controlling the chemical composition of co-catalysts (Tokyo Univ. of Sci.)*Yuichi Negishi,Yoshiki Matsuura,Ryota Tomizawa,Mamiko Omatoi,Shihori Kajino,Takumi Terui,Daiki Ishii,Tomoaki Takayama,Akihide Iwase,Akihiko Kudo |
| 15:08-15:26 | 1C16 | Quantum-sized gold cluster with fcc structure: synthesis and observation of near IR band (School of Science, The Univ. of Tokyo1,ESICB, Kyoto Univ.2)*Shinjiro Takano1,Seiji Yamazoe1,2,Kiichirou Koyasu1,2,Tatsuya Tsukuda1,2 |
| 15:26-15:44 | 1C17 | Geometric and Electronic Structures of Shape-Regulated Novel Gold Cluster Family (Graduate School of Environmental Science, Hokkaido Univ.)*Yukatsu Shichibu,Mingzhe Zhang,Katsuaki Konishi |
| 15:44-16:02 | 1C18 | Electronic-Structure Analysis of Cerium Oxide Clusters by X-ray Absorption Spectroscopy (Genesis Res. Inst., Inc.1,Kyushu Univ.2,Toyota Tech. Inst.3)*Tetsuichiro Hayakawa1,Masashi Arakawa2,Shun Sarugaku2,Kota Ando2,Kenichiro Tobita2,Tomonori Ito2,Kazuhiro Egashira1,Akira Terasaki2,3 |
| 16:02-16:20 | 1C19 | Formation of bauxite-composition clusters from aluminum cluster cations exposed to O2 and H2O (Department of Chemistry, Kyushu Univ.)*Masashi Arakawa,Kei Kohara,Akira Terasaki |
| 13:20-13:38 | 1D10 | Theoretical study on charge state dependence of third-order nonlinear optical property for one-dimensional phenalenyl radical aggregates (Department of Chemical Engineering, NNCT1,Graduate School of Engineering Science, Osaka University2)*Kyohei Yoneda1,Kotaro Fukuda2,Masayoshi Nakano2 |
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| 13:38-13:56 | 1D11 | Study on biradical compounds showing structural phase transition (Grad. Sch. Sci. Eng., The Univ. of Electro-Communications)*Toru Yoshitake,Takayuki Ishida |
| 13:56-14:14 | 1D12 | Orbital symmetries and magnetic field effects in a symmetric indoletrimer carrying three nitronyl nitroxides (Dept. of Chemistry, Nagoya Univ.1,RCMS, Nagoya Univ.2)*Michio Matsushita1,Yudai Ishii1,Kunio Awaga2,1 |
| 14:14-14:32 | 1D13 | The relation between crystal structures and spin frustration in k-(ET)2X complexes (Faculty of Agriculture, Meijo Univ.1,Graduate School of Science, Nagoya Univ.2,Graduate School of Science, Kyoto Univ.3,Graduate School of Engineering, Nagoya Univ.4,LTM Center, Kyoto Univ.5)*Takaaki Hiramatsu1,Hiromi Hayama1,Yukihiro Yoshida1,Yasuhiro Shimizu2,Mitsuhiko Maesato3,Hiroshi Ito4,Hideo Kishida4,Akihiro Otsuka5,Hideki Yamochi5,Gunzi Saito1 |
| 14:32-14:50 | 1D14 | Synthesis and Dielectric Properties of a [Ni(dmit)2]- Crystal with a Aminopyridinium/Chiral Crown Ether Cation (Graduate School of Environmental Science, Hokkaido University1,Research Institute for Electronic Science, Hokkaido University2,Institute of Multidisciplinary Research for Advanced Materials, Tohoku University3)*Daiki Watanabe1,Kazuya Kubo1,2,Norihisa Hoshino3,Tomoyuki Akutagawa3,Shin-ichiro Noro1,2,Takayoshi Nakamura1,2 |
| 14:50-15:08 | 1D15 | REVERSIBLE SINGLE-CRYSTAL TO SINGLE-CRYSTAL TRANSFORMATIONS AND ASSOCIATED MAGNETISM OF A CYANIDE-BRIDGED CHIRAL MAGNET (Department of Chemistry, Graduate School of Science, Hiroshima Univ.1,Institute for Advanced Materials Research, Hiroshima Univ.2)*Li Li1,Sadafumi Nishihara1,2,Katsuya Inoue1,2 |
| 15:08-15:26 | 1D16 | Theoretical calculations of zero-field splitting parameter D for mononuclear complex and multivariate analysis of the results (Graduate School of Science, Osaka Univ.)*Takashi Kawakami,Keiji Kinoshita,Toru Saito,Yasutaka Kitagawa,Shusuke Yamanaka,Kizashi Yamaguchi,Mitsutaka Okumura |
| 15:26-15:44 | 1D17 | f-pi interaction in excited states of porphyrin double-decker lanthanide complexes (Graduate School of Science, Osaka Univ.)*Yudai Nakae,Akira Fuyuhiro,Takamitu Fukuda,Naoto Ishikawa |
| 15:44-16:02 | 1D18 | Theoretical studies on magnetic interactions of f-pi orbitals in TbPc2 complex (Graduate School of Science, Osaka University1,Graduate School of Science, Tohoku University2,JST CREST3)*Yasutaka Kitagawa1,3,Hiroyuki Kurahashi1,Keiichi Katoh2,3,Takashi Kawakami1,Shusuke Yamanaka1,Masahiro Yamashita2,3,Mitsutaka Okumura1 |
| 16:02-16:20 | 1D19 | Anomalous physical properties of iodine-bond-type π-d mixed crystal system (DIETSe)2MBr4xCl4(1-x) [M = Fe, Ga] (Grad. Sch. Sci., Kyoto Univ.1,Nagaoka Univ. Tech.2,NHMFL3)*Genta Kawaguchi1,Mitsuhiko Maesato1,Hiroshi Kitagawa1,Tatsuro Imakubo2,Graf David3,Kiswandhi Andhika3,S. brooks James3 |
| 13:20-13:56 | 1E10 | [Invited Talk]Spatio-temporal heterogeneous dynamics in condensed phase (Institute for Molecular Science)*Shinji Saito |
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| 13:56-14:14 | 1E12 | Development of a hybrid framework of first principle molecular orbital calculation and a three-dimensional theory of molecular solvation (MC-MOZ method) (Japan Atomic Energy Agency1,Graduate School of Engineering, Kyoto Univ.2,Graduate School of Science, Nagoya Univ.3)*Kentaro Kido1,Kento Kasahara2,Daisuke Yokogawa3,Hirofumi Sato2 |
| 14:14-14:32 | 1E13 | Development of a QM/MM method with perturbation approach combined with a theory of solutions (Graduate School of Science, Tohoku Univ.)*Daiki Suzuoka,Hideaki Takahashi,Akihiro Morita |
| 14:32-14:50 | 1E14 | Automated search for minimum energy conical intersection geometries near the Franck-Condon region : toward the theoretical design of photo-functional molecules (Faculty of Science, Hokkaido Univ.1,Fukui Institute for Fundamental Chemistry, Kyoto Univ.2)*Yu Harabuchi1,Satoshi Maeda1,Tetsuya Taketsugu1,Keiji Morokuma2 |
| 14:50-15:08 | 1E15 | An extraction of hierarchical organization of embedded timescales buried in complex reaction network (Graduate School of Life Science, Hokkaido Univ,1,Graduate School of Science, Hokkaido Univ,2,Research Institute for Electronic Science, Hokkaido Univ.3,Information technology center, Saitama Univ.4)*Yutaka Nagahata1,Satoshi Maeda2,Hiroshi Teramoto1,3,Chun-biu Li3,Takashi Horiyama4,Tetsuya Taketsugu2,Tamiki Komatsuzaki1,3 |
| 15:08-15:26 | 1E16 | Basic structure in equation of state of hydrocarbon (Hosei Univ.1,Tokyo Denki Univ.2)*Yosuke Kataoka1,Yuri Yamada2 |
| 15:26-15:44 | 1E17 | Theoretical study on Nearsightedness of finite systems based on linear response analysis (Graduate School of Science, Osaka Univ.1,Institute of Nano Science design, Osaka Univ.2,Protein Institute, Osaka Univ.3)Yuki Mitsuta1,*Shusuke Yamanaka1,Yasutaka Kitagawa1,Takashi Kawakami1,Kizashi Yamaguchi2,Mitsutaka Okumura1,Haruki Nakamura3 |
| 15:44-16:02 | 1E18 | Theoretical study of excitation energy transfer in thermo-sensitive lanthanide luminescence probes (FIFC Kyoto Univ.)*Miho Hatanaka,Keiji Morokuma |
| 16:02-16:20 | 1E19 | Characterization and reactivity analysis of densely lying electronic states; sensitibity analysis on nonadiabaticity in a boron cluster system (Department of Basic Science, The University of Tokyo1,CMSI2,TCCI3)*Takehiro Yonehara2,3,1,Kazuo Takatsuka1,3,2 |