分子科学会

Oral Sessions

Tuesday, September 22 (Starting at 9:30)

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 22, starting at 9:30)

Venue A [Gas phase]

9:30-9:48 4A01Research of trans-stilbene S1←S0 transition by high-resolution laser spectroscopy
(Graduate School of Science, Kobe Univ1,Molecular Photoscience Research Center, Kobe Univ2,CONFLEX Co.3) *Akira Shimizu1, Shunji Kasahara2, Masaaki Baba2, Naofumi Nakayama3
9:48-10:06 4A02Study on the electronic structure of HMNTA as a model extractant for minor actinide recovery
(Japan Atomic Energy Agency1,Sophia University2,University of Hyogo3,High Energy Accelerator Research Organization4) *Yasunori Miyazaki1, Yuichi Sano1, Masayuki Takeuchi1, Masamitsu Hoshino2, Tatsuo Gejo3, Jun-ichi Adachi4
10:06-10:24 4A03An explanation of the K-type doubling in K=1 levels of CH3+-He
(ILS, ECU1,Univ. Cologne2) *Koichi Yamada1, Oskar Asvany2, Stephan Schlemmer2
10:24-10:42 4A04Vibrationally averaged structure of benzene: Assertion from computational molecular spectroscopy
(Ochanomizu Univ.1,Gifu Univ.2,Yokohama City Univ.3,Kyoto Univ.4) *Tsuneo Hirano1, Taro Udagawa2, Hikaru Tanaka2, Kazuaki Kuwahata3, Masanori Tachikawa3, Umpei Nagashima3, Masaaki Baba4
11:00-11:18 4A05Attosecond optical and Ramsey-type interferometry by post-generation splitting of high-order harmonic pulse
(School of Science, The Univ. of Tokyo1,Attosecond Science Research Team, RAP, RIKEN2,Graduate School of Engineering, The Univ. of Tokyo3) *Takuya Matsubara1,2, Yasuo Nabekawa2, Kenichi Ishikawa3, Kaoru Yamanouchi1, Katsumi Midorikawa2
11:18-11:36 4A06Non-dipole effect on core-level photoemission time delay of homonuclear diatomic molecules
(Dep. Phys., Univ. Toyama1,RAP, RIKEN2,Graduate School of Science, Tohoku Univ.3) *Yoshiaki Tamura1, Kaoru Yamazaki2, Kiyoshi Ueda3, Keisuke Hatada1
11:36-11:54 4A07Two-color x-ray pump-probe spectroscopy for capturing femtosecond x-ray induced nonadiabatic reaction dynamics
(RAP, RIKEN1,JST-PRESTO2) *Kaoru Yamazaki1,2, Katsumi Midorikawa1
11:54-12:12 4A08Ultrafast photoelectron spectroscopy of photoisomerization reaction of ethylene
(Graduate School of Science, Kyoto Univ.1,NYU-ECNU Center for Computational Chemistry, NYU Shanghai2,Department of Chemistry, New York University3) *Shutaro Karashima1, Alexander Humeniuk2, William j. Glover2,3, Suzuki Toshinori1

Venue B [Surface/Interface]

9:48-10:06 4B02Absorption cross section of three-coordinated dangling-OH bonds on amorphous water
(Komaba Institute for Science,The University of Tokyo) *Tetsuya Hama, Takumi Nagasawa, Reo Sato, Takeshi Hasegawa, Naoki Numadate
10:06-10:24 4B03Structural characterizing of vapor deposited amorphous water and crystallization dynamics
(Komaba Institute for Science, The University of Tokyo) *Takumi Nagasawa, Takeshi Hasegawa, Naoki Numadate, Tetsuya Hama
10:24-10:42 4B04Identification of the crystalline structure of ice formed at extremely low temperature through water/neon matrix sublimation
(Komaba Institute for Science) *Reo Sato, So Taniguchi, Naoki Numadate, Tetsuya Hama
11:00-11:18 4B05Experimental and theoretical Raman spectroscopy of ice VI
(Graduate School of Science and Engineering, Saitama Univ.) *Tetsuyuki Takayama, Miyuki Sakaguchi, Takuhiro Otosu, Shoichi Yamaguchi
11:18-11:36 4B06Experimental and theoretical HD-SFG spectroscopy of water surface
(Graduate School of Science and Engineering, Saitama Univ.) Yuki Goto, Tetsuyuki Takayama, Miyuki Sakaguchi, Takuhiro Otosu, *Shoichi Yamaguchi
11:36-11:54 4B07Ultrafast spectral diffusion of hydrogen-bonded OH stretch at the air/H2O interface investigated by cutting-edge interferometric 2D HD-VSFG spectroscopy
(Molecular Spectroscopy Laboratory, RIKEN1,Ultrafast Spectroscopy Research Team, RIKEN Center for Advanced Photonics (RAP), RIKEN2) *Woongmo Sung1, Satoshi Nihonyanagi1,2, Tahei Tahara1,2
11:54-12:12 4B08Surface-selective spectroscopic observation of hydrogen-bond network at electrode surfaces
(Nagoya Inst. Tech.) Ryuto Kamimura, Taichi Isogai, Kenta Motobayashi, *Katsuyoshi Ikeda

Venue C [Clusters/particles/nanostructures]

9:48-10:06 4C02Thermoresponsive behavior induced by plasmonic heating of copper nanoparticles
(Graduate School of Science Engineering, Chuo Univ.1,Faculty of Science Engineering, Chuo Univ.2) *Shunya Sakane1, Toshiki Anji1, Itsuki Yamagishi2, Issei Kohara2, Hideki Tanaka1
10:06-10:24 4C03Synthesis of Au25(SR)18 superatoms using dendrimer complexes
(Chem. & Life Sci., Tokyo Institute of Technology1,JST-ERATO2,JST-PRESTO3) *Hisanori Muramatsu1, Tetsuya Kambe1,2, Takamasa Tsukamoto1,2,3, Takane Imaoka1,2, Kimihisa Yamamoto1,2
10:24-10:42 4C04Modulation of the electron affinities of XAg12 superatoms (X = Au, Ag) by surface ligands
(Graduate School of Science, Univ. Tokyo) *Katsunosuke Nakamura, Shun Ito, Kiichirou Koyasu, Tatsuya Tsukuda
11:00-11:18 4C05Theoretical study of reactivity of solvation clusters of hypervalent radicals, NH4 and H3O
(Department of Liberal Arts, The Open University of Japan1,College of Liberal Arts and Sciences, Kitasato University2) *Kenro Hashimoto1, Taku Shimosato1, Kta Daigoku2
11:18-11:36 4C06A general theory on the reaction pathway selection for the coordination self-assembly under kinetic control
(Graduate School of Arts and Sciences, The University of Tokyo1,Department of Molecular Engineering, Kyoto University2,ESICB, Kyoto University3,Fukui Institute for Fundamental Chemistry, Kyoto University4) *Satoshi Takahashi1, Hirofumi Sato2,3,4, Shuichi Hiraoka1
11:36-11:54 4C07Interfacial Potential Dependence on Elementary Exciton Processes of InP-based Quantum Dots
(Graduate School of Science and Technology) *Kazuki Inada, Daichi Eguchi, Naoto Tamai
11:54-12:12 4C08Pressure Effect on Elementary Exciton Processes of CdTe Quantum Dots
(Graduate School of Science and Technology, Kwansei Gakuin Univ.) *Makoto Kotake, Naoto Tamai, Daichi Eguchi

Venue D [Solid phase]

9:30-9:48 4D01Crystal structure and physical properties of naphthalenediimide derivatives with flexible anionic arm
(Graduate School of Engineering, Tohoku University1,Institute of Multidisciplinary Research for Advanced Materials, Tohoku University2,Graduate School of Science and Technology, Niigata University3,Graduate School of Engineering, Kyoto University4) *Ryo Ide1, Takashi Takeda1,2, Norihisa Hoshino3, Wakana Matsuda4, Shu Seki4, Tomoyuki Akutagawa1,2
9:48-10:06 4D02Development of plastic/ferroelectric crystals
(Faculty of Science, Hokkaido Univ.1,Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.2) *Jun Harada1,2, Haruka Takahashi2, Mika Takehisa1, Yukihiro Takahashi1,2
10:06-10:24 4D03Molecular Design, Magnetism and Ionic Conduction of Redox-active Organic Ionic Plastic Crystals
(College of Chemistry and Molecular Engineering, Nanjing Tech University1,Graduate School of Advanced Science and Engieering, Hiroshima University2,Chirality Research Center (CResCent), Hiroshima University3,Institute for Advanced Materials Research, Hiroshima University4) *Yin Qian2,1, Dong-sheng Shao1, Xiao-ming Ren1, Sadafumi Nishihara2,3,4
10:24-10:42 4D04Physical properties of Preyssler-type polyoxometalates encapsulated with lanthanide ions single crystal
(Graduate School of Advanced Science and Engineering, Hiroshima Univ.1,Chirality Research Center (CResCent), Hiroshima Univ.2,Institute for Advanced Materials Research, Hiroshima Univ.3,Graduate School of Sciences and Technology for Innovation, Yamaguchi Univ.4,PRESTO, JST5) *Chisato Kato1, Masaru Fujibayashi1, Goulven Cosquer1,2, Katsuya Inoue1,2,3, Ryo Tsunashima4, Sadafumi Nishihara1,2,3,5
11:00-11:18 4D05Bose enhancement of excitation-energy transfer with molecular-exciton-polariton condensates
(Graduate School of Engineering, Kyoto University) *Thanhphuc Nguyen
11:18-11:36 4D06Light emitting devices based on thin films doped with chiral perylene diimide derivatives
(Graduate School of Science and Engineering, Ibaraki Univ1,Graduate School of Science, Kitasato Univ2,Graduate School of Science and Engineering, Kindai Univ3) *Yuki Nishimura1, Masashi Hasegawa2, Yasuhiro Mazaki2, Yoshitane Imai3, Hiroyuki Nishikawa1
11:36-11:54 4D07Excitation wavelength dependence of lasing dynamics in lead halide perovskite microcrystal by femtosecond transient absorption microscopy
(Institute of post-LED photonics, Tokushima Univ.1,Graduate School of Advanced Engineering and Science, Tokushima University2) *Tetsuro Katayama1, Yuma Fujita2, Akihiro Furube1
11:54-12:12 4D08Photoluminescence and arrangement of platinum-thiolate macrocyclic compounds in solid phase
(Faculty of Environmental Earth Science, Hokkaido Univ.1,Graduate School of Environmental Science, Hokkaido Univ.2) *Yukatsu Shichibu1,2, Kasei Ryu2, Shogo Shimada2, Katsuaki Konishi1,2

Venue E [Theory/Calculation]

9:30-9:48 4E01AAM and CGM Hybrid Scale Simulation Study for Structure-Activity Relationship
(CCS, Tsukuba Univ.) *Hiromitsu Shimoyama, Yasuteru Shigeta
9:48-10:06 4E02Theoretical study on drug resistance factors of antiviral drugs caused by amino acid mutations
(Graduate school of Medicine, Nagoya Univ.1,Graduate School of Science, Nagoya Univ.2,Graduate School of Medicine, Hokkaido Univ.3) *Jun Koseki1, Shuto Hayashi1, Yasuhiro Kojima1, Haruka Hirose1, Shingo Iwami2, Takasuke Fukuhara3, Teppei Shimamura1
10:06-10:24 4E03Energy landscape and folding transitions of chignolin III
(Faculty of Mathematics and Physics, Kanazawa University1,Guraduate School of Natural Science and Technology, Kanazawa Univerisity2) Yuto Yamada2, Daisuke Suzuki2, *Shinichi Miura1
10:24-10:42 4E04Development of replica permutation with solute tempering and improvement in the list of permutation candidates
(The Graduate University for Advanced Studies1,Institute for Molecular Science2,Graduate School of Science, Kyoto Univ.3,Exploratory Research Center on Life and Living Systems4) *Daiki Fukuhara1,2, Masataka Yamauchi3, Satoru g. Itoh1,2,4, Hisashi Okumura1,2,4
11:00-11:18 4E05Electronic fluctuation in physiological solutions: Effective fragment potential-molecular dynamics simulation of trimethylamine N-oxide and tert-butyl alcohol
(Faculty of Science and Engineering, Chuo Univ.1,JST ACT-X2,Graduate School of Humanities and Sciences, Ochanomizu Univ.3) *Nahoko Kuroki1,2, Yukina Uchino3, Tamon Funakura1, Hirotoshi Mori1
11:18-11:36 4E06Markov State Model Study of Self-Assembled Structures of V-Shaped Polycyclic Aromatic Amphiphiles
(Graduate School of Science, Kyoto Univ.1,National Institutes for Quantum and Radiological and Technology2) *Yuki Yamamoto1, Masahiko Taguchi2, Daichi Tanaka1, Shigehiko Hayashi1
11:36-11:54 4E07On the calculation of long-range electrostatic interactions in molecular simulation
(QST) *Yoshiteru Yonetani
11:54-12:12 4E08Accelerating Monte Carlo molecular simulations using self-learning continuous normalizing molecular flow
(Dept. of Mech Eng., Keio Univ.) *Katsuhiro Endo, Kenji Yasuoka

Tuesday Afternoon Sessions(September 22, starting at 15:00)

Venue A   [Gas phase]

15:00-15:18 4A09Time-of-flight mass spectrometric study of association reaction of hexane in femtosecond laser filaments
(Grad. Sc. Sci., Nagoya U1,RCMS, Nagoya U2) *Akitaka Matsuda1, Yuya Okumura1, Akiyoshi Hishikawa1,2
15:18-15:36 4A10Identification of the reaction intermediates of HFO-1123 disproportionation reaction using the results of time-resolved spectroscopic measurements.
(Tokyo Gakugei Univ.1,Panasonic Corp.2) *Karin Domoto1, Sae Fujita1, Hikaru Murakami2, Hirotaka Kitagawa2, Takahiko Hashimoto2, Yukio Nakano1
15:36-15:54 4A11Ultrafast mode-selective excitation of large-amplitude vibration in diphenylmethane
(Tokyo Tech) *Makoto Nikaido, Yasuhiro Ohshima
15:54-16:12 4A12Ultrafast internal conversion in nucleobases
(Department of Chemistry, Kyoto University) Yuta Miura, Shutaro Karashima, Yo-ichi Yamamoto, Natsumi Orimo, *Toshinori Suzuki

Venue B  [Surface/Interface]

15:00-15:18 4B09Control of Interfacial Water Structures using Metal Nano Structures for Effective Hydrogen Evolution Reaction
(Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1,Department of Chemical Science and Engineering, Faculty of Engineering Graduate School of Engineering, Kobe Univ.2,Department of Chemistry, Faculty of Science, Hokkaido Univ.3) *Nobuaki Oyamada1, Hiro Minamimoto2, Kei Murakoshi3
15:18-15:36 4B10Identification of reactive electrons for photocatalytic hydrogen evolution by operando infrared spectroscopy synchronized with cyclic excitation
(Department of Materials Molecular Science, IMS1,Department of Functional Molecular Science, SOKENDAI2,Innovative Optics and Photonics, PRESTO-JST3,RIKEN SPring-8 Center4) *Hiromasa Sato1,2, Toshiki Sugimoto1,2,3,4
15:36-15:54 4B11In-situ observation of H2 and N2 adsorption states on the surface of Ru/MgO ammonia synthesis catalysts using modulation excitation infrared spectroscopy
(IMCE, Kyushu Univ.1,Graduate School of Advanced Science and Engineering, Hiroshima Univ.2,WPI-I²CNER, Kyushu Univ.3,WPI-AIMR, Tohoku Univ.4) *Tomohiro Noguchi1, David s. rivera Rocabado2, Takayoshi Ishimoto2, Miho Yamauchi1,3,4

Venue C  [Clusters/particles/nanostructures]

15:00-15:18 4C09Combined measurement on charged nanodroplets from electrospray ionization by ion mobility
(Department of Chemistry, Toho University) Kisuke Tsunemi, Shoma Miyanishi, *Toshiki Sugai
15:18-15:36 4C10Second harmonic generation from gold nanoplates excited by spatially modulated light
(Graduate School of Advanced Science and Engineering, Waseda Univ.) *Seiju Hasegawa, Honoka Ichikawa, Haruka Iijima, Kohei Imura
15:36-15:54 4C11Theoretical Study on Direction of Polymer Elongation Reaction in PCP/MOF Nanochannels
(Graduate School of Informatics, Nagoya Univ.1,CREST-JSTA2,DS center, Shiga Univ.3,RIKEN, AIP4,School of Statistical Thinking, ISM5,FV-CRC, Nagoya Univ.6) *Zizhen Rao1, Masayoshi Takayanagi2,3,4,5, Masataka Nagaoka1,2,6
15:54-16:12 4C12Effect of an External DC Electric Field on the order of Polymer-Capped Gold Nanorods: Formation of Smectic, Tetragonal, and Hexagonal Structures
(Aichi Univ. of Education1,Graduate School of Science and Technology, Gunma Univ.2) *Kazuyuki Hino1, Toshiaki Fukagawa1, Ryo Tajima1, Yoshihiro Yamaguchi1, Hiroaki Tanaka1, Kouki Morikawa1, Shunsuke Tanaka1, Yoshikiyo Hatakeyama2

Venue D  [Liquid phase]

15:00-15:18 4D09Dispersive XAFS study on the laser-induced reduction of a Rh3+ ion complex in a H2O/EtOH solution
(QST1,JAEA2) *Morihisa Saeki1, Daiju Matsumura2, Ryuzo Nakanishi1, Takumi Yomogida2, Takuya Tsuji2, Hiroyuki Saitoh1, Hironori Ohba1
15:18-15:36 4D10Estimation of conformational entropy in ionic liquids.
(Graduate School of Science and Engineering, Doshisha Univ.1,Faculty of Science and Engineering, Doshisha Univ.2) *Hiroki Sumida1, Yoshifumi Kimura1,2, Takatsugu Endo2
15:36-15:54 4D11NMR chemical shift calculation considering solvation: RISM-SCF-cSED approach
(Department of Engineering, Kyoto University1,Graduate School of Arts and Science, The University of Tokyo2,Fukui Institute for Fundamental Chemistry, Kyoto University3) *Kosuke Imamura1, Daisuke Yokogawa2, Masahiro Higashi1, Hirofumi Sato1,3
15:54-16:12 4D12Elucidation on the behavior of high concentrated electrolytes of K-ion secondary batteries
(NIMS) *Kenichi Koizumi, Yoshitaka Tateyama

Venue E  [Biomolecules]

15:00-15:18 4E09Technical development toward cryogenic fluorescence microscopy of cell
(Department of Physics, Tokyo Tech) Kanta Naruse, Naoki Kamiya, Kazuki Kuramoto, Takuma Yorita, Hidekazu Aramaki, Michio Matsushita, *Satoru Fujiyoshi
15:18-15:36 4E10Intracellular NO release material for nanowire single-cell endoscopy
(KUIAS, Kyoto Univ.1,RIES, Hokkaudo Univ.2,KU Leuven3) *Tomoko Inose1, Javier Troyano1, Shun Tokuda1, Qiang Zhang2, Eli Sanchez-gonzales1, Beatrice Fortuni3, Kenji Hirai2, Hiroshi Uji-i2,3,1, Shuhei Furukawa1
15:36-15:54 4E11Amplification of the specific conformational fluctuation of proteins by site-specific mutagenesis and hydrostatic pressure: Outer Surface Protein A (OspA)
(College of Pharmaceutical Sciences, Ritsumeikan Univ.1,Graduate School of Life Science, Ritsumeikan Univ.2,Graduate School of Pharmaceutical Sciences, Ritsumeikan Univ.3) *Soichiro Kitazawa1, Takuro Wakamoto2, Junya Yamamoto3, Rena Koide3, Ryo Kitahara1
15:54-16:12 4E12Direct observation of unfolding dynamics of the amyloidosis related protein in droplets formed via liquid-liquid phase separation by autofluorescence measurement
(Graduate School of Pharmaceutical Sciences, Tohoku Univ.1,JST PREST2) *Uchu Matsuura1, Shinya Tahara1, Shinji Kajimoto1,2, Takakazu Nakabayashi1