Japan Society for Molecular Science.
he 18th Annual Meeting of Japan Society for Molecular Science 2024
he 18th Annual Meeting of Japan Society for Molecular Science 2024
he 18th Annual Meeting of Japan Society for Molecular Science 2024
he 18th Annual Meeting of Japan Society for Molecular Science 2024

Oral Sessions

Wednesday, September 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 room.


Wednesday Morning Sessions(September 18, starting at 9:00)

Room A [Gas phase]

09:18-09:36
1A02 Millimeter-wave rotational spectroscopy and the astronomical detection of CH317OH
(RIKEN Cluster for Pioneering Research1,Materials Science and Engineering, College of Engineering, Shibaura Institute of Technology2,Universit´e Paris-Est Cr´eteil3,University of Toyama4,Graduate School of Informatics and Engineering, The University of Electro Communications5) *Takahiro Oyama1, Akemi Tamanai1, Yoshimasa Watanabe2, Isabelle Kleiner3, Kazuha Nakamura4, Kaori Kobayashi4, Takeshi Sakai5, Nami Sakai1
09:36-09:54
1A03 High-resolution laser spectroscopy of 14NO2 radical in the 615 nm region
(Graduate School of Engineering, Kyoto Univ.1,Faculty of Science, Kobe Univ.2,Molecular Photoscience Research Center, Kobe Univ.3) *Kohei Tada1, Sakura Torao2, Honoka Minamide2, Takumi Yoshizawa2, Shunji Kasahara3
09:54-10:12
1A04 LIF spectroscopy of jet cooled SiNSi -vibrational analysis of the DF spectra-
(Graduate School of Information Sciences, Hiroshima City Univ.1,Department of Basic Science, The University of Tokyo2) *Fukushima Masaru1, Takashi Ishiwata1, Chihaya Motoyoshi2, Yoshihide Sumiyoshi2, Yasuki Endo2
10:12-10:30
1A05 Laser spectroscopy of new A2Pi-X2Sigma bands of CaH in the UV region
(Graduate School of Science and Engineering, Toyama Univ) *Jiahui Xiong, Hideto Shinbashi, Kaori Kobayashi, Yoshiki Moriwaki
10:48-11:06
1A07 Vibronic structure of carbon cluster anion C6- exhibiting fast radiative cooling
(Fukui Institute for Fundamental Chemisty, Kyoto Univ.1,Graduate School of Engineering, Kyoto Univ.2) *Tetsuri Takami1,2, Naoki Haruta1,2, Tatsuhisa Kato1, Tohru Sato1,2
11:06-11:24
1A08 The study of trans-stilbene S1←S0 transition by the crossed beam-laser technique.
(Graduate School of Science, Kobe Univ1,Molecular Photoscience Research Center, Kobe Univ2,CONFLEX Co.3) *Akira Shimizu1, Shunji Kasahara2, Masaaki Baba2, Naofumi Nakayama3
11:24-11:42
1A09 Assignment of 0-0 bands in S0-S1 electronic transition for Anti and Gauche conformational isomers from 2-photon fluorescence excitation spectrum and analysis of large-amplitude motions
(Graduate School of Engineering, Nihon Univ.1,College of Engineering, Nihon Univ.2) Kohei Chiba1, Ryoko Suzuki1, *Katsuhiko Okuyama2
11:42-12:00
1A10 Schrödinger cat: a linear molecule is observed as being bent.
(Faculty of Science, Ochanomizu Univ.1,Graduate School, Yokohama City Univ.2,Photoscience Research Center, Kobe Univ.3) *Tsuneo Hirano1, Umpei Nagashima2, Masaaki Baba3

Room B [Clusters/Surface]

09:18-09:36
1B02 Visualization and characterization of propagating surface plasmons photofunctionalized by quantum dots
(Graduate School of Engineering, Osaka Metropolitan University) *Kazuki Kamada, Daegwi Kim, Masahiro Shibuta
09:36-09:54
1B03 Elucidation and Control of a Junction Structure of Single-Molecule Junction using Localized Surface Plasmon
(Dept. of Mater. Sci. and Eng., Tokyo Tech.) *Kaneko Satoshi
09:54-10:12
1B04 Exfoliation of Cu ladder with psuedo-1D chain structure and its electrical properties
(Grad. Sch. Adv. Sci. Eng. Hiroshima Univ.1,CResCent, Hiroshima Univ.2,WPI-SKCM2, Hiroshima Univ.3,NIT, Ube College4,PRESTO, JST5) *Rikuto Tamatani1, Masaki Arima1, Yuki Nakano1, Chisato Kato1, Jun Manabe1, Goulven Cosquer2,3, Masaru Fujibayashi4, Katsuya Inoue1,2,3, Sadafumi Nishihara1,2,5
10:12-10:30
1B05 Semiclassical theory of molecular vibration-polariton dynamics: water molecules strongly coupled to an infrared cavity
(Graduate School of Engineering, Kyoto University) *Thanh phuc Nguyen, Takumi Hidaka, Hirofumi Sato
10:48-11:06
1B07 Molecular science for nanocluster superatoms on heterogeneous interfaces
(Faculty of Science and Technology, Keio Univ.) *Atsushi Nakajima, Takumi Ichikawa, Kazuya Terasaka, Tomoya Inoue
11:06-11:24
1B08 Ultrafast Charge Transfer Dynamics at the Aromatic Molecules /Gold Nanoparticles Interface Using Static Synchrotron Spectroscopy
(Graduate School of Advanced Science and Engineering, Hiroshima Univ.1,Graduate School of Humanities and Social Sciences, Hiroshima Univ.2,Photon Factory, Institute of Materials Structure Science, KEK3,Research Institute for Synchrotron Radiation Science, Hiroshima Univ.4) *Shogo Tendo1, Akinobu Niozu2, Kakuto Yoshioka1, Jun-ichi Adachi3, Hirokazu Tanaka3, Shohei Asakura1, Yuri Ohura1, Shin-ichi Wada1,4
11:24-11:42
1B09 IR ATR analysis of molecular disaggregation of PTFE with NaCl
(ICR, Kyoto Univ.1,School of Science, Tokyo Institute of Technology.2,IMRAM, Tohoku Univ.3) *Tomoya Oonuki1, Taisuke Araki1, Taizo Mori1, Nobutaka Shioya1, Takeshi Hasegawa1, Akihide Hibara2, Junya Kano3
11:42-12:00
1B10 Hydrogen radical addition and electron transfer for a functional monolayer film
(Graduate School of Science, Osaka Univ1,Graduate School of Advanced Science and Engineering, Hiroshima Univ2,Graduate School of Science, Yokohama City Univ3) *Mizuho Muroyama1, Nano Kobayakawa1, Seiya Watanabe1, Yusuke Kanematsu2, Masanori Tachikawa3, Megumi Akai1, Hiroyuki Kato1

Room C [Solid phase]

09:54-10:12
1C04 Experiment on over 1 GHz magnet and development of an ultra-high-resolution probe for next-generation solid-state NMR
(School of Life Science and Technology, Tokyo Institute of Technology1,Center for Biosystems Dynamics Research (BDR), RIKEN2,RIKEN Cluster for Science, Technology and Innovation Hub (RCSTI), RIKEN3,NB business Unit, JEOL Ltd.4) *Tatsuya Matsunaga1,2, Masato Takahashi1,2, Toshio Yamazaki2, Yoshinori Yanagisawa2,3, Renzhong Piao2, Yuuki Endo4, Kenichi Hachitani4, Hiroshi Kato4, Takahiro Nemoto4, Yoshitaka Ishii1,2
10:12-11:06
1C05 Superperiodic Structure of Pd/Sr3Ti2O7
(Fukui Institute for Fundamental Chemistry, Kyoto Univ.1,Graduate School of Engineering, Kyoto Univ.2,Kyoto Institute of Technology3,National Defense Academy of Japan4) *Ota Wataru1,2, Onishi Shunya1,2, Laetitia-eiko Xerri1, Saburo Hosokawa3, Toyokazu Tanabe4, Kentaro Teramura2, Tsunehiro Tanaka2, Tohru Sato1,2
10:30-10:48
1C06 First-principles calculations of carrier dynamics on oxysulfide photocatalyst Ln2Ti2O5S2 (Ln=Pr, Nd, Sm, Gd,Tb, Dy, Er)
(Graduate School of Bionanoscience, Yokohama City Univ.) Masanori Kaneko, *Koichi Yamashita
11:06-11:24
1C08 antenna effect via multiple triplet states in lanthanoid complex with π-stacked dimeric structure
(Graduate School of Sciences and Technology for Innovation, Yamaguchi University1,Graduate School of Environmental Studies, Tohoku University2) *Atsuko Masuya-suzuki1, Maki Tatehara1, Mako Komatsu2, Ryunosuke Karashimada2, Nobuhiko Iki2, Ryo Tsunashima1
11:24-11:42
1C09 Structure and Characterization of Metal Complexes with Azobisphenolate Ligands Having Electron-Donating Substituents
(Graduate School of Science, Kobe University1,Research Center for Membrane and Film Technology, Kobe University2,Research Facility Center for Science and Technology, Kobe University3,Molecular Photoscience Research Center, Kobe University4) *Taisei Kasazaki1, Tomoyuki Mochida1,2, Takahiro Sakurai3, Susumu Ohkubo4, Hitoshi Ohta4, Kazuyuki Takahashi1
11:42-12:00
1C10 Interaction Energy Analysis for Spin Crossover Iron Complexes
(Graduate School of Science, Kobe Univ.1,Research Center for Membrane and Film Technology, Kobe University2,Research Facility Center for Science and Technology, Kobe University3,Molecular Photoscience Research Center, Kobe University4) *Kazuyuki Takahashi1, Kazuki Matsumoto1, Ryosuke Azuma1, Tomoyuki Mochida1,2, Takahiro Sakurai3, Susumu Okubo4, Hitoshi Ohta4

Room D [Liquid phase]

09:36-09:54
1D03 Experimental evidence for the alternation of photoisomerization velocities in light-driven self-oscillating crystals
(Faculty of Science, Hokkaido University) *Yoshiyuki Kageyama, Makiko Matsuura, Daisuke Yazaki
09:54-10:12
1D04 Photoelectron spectroscopy reveals surface propensity and orientation of atmospheric molecules in aqueous solution
(Kyoto University1,Fritz Haber Institut2,Uppsala University3) *Stephan Thuermer1, Harmanjot Kaur2, Bernd Winter2, Olle Bjoerneholm3
10:12-10:30
1D05 Probing isolated water molecules in aqueous acetonitrile solutions using soft X-ray absorption spectroscopy
(IMS1,SOKENDAI2) *Masanari Nagasaka1,2
10:48-11:24
1D07 [Young Scientist Award Talk] Structural chemistry by fluctuation measurement using inelastic scattering
(Shibaura Institute of Technology) *Takashi Hiroi
11:24-11:42
1D09 Unraveling the dynamic slowdown in supercooled water: The role of dynamic disorder in jump motions
(Inst. for Mol. Sci.) *Shinji Saito
11:42-12:00
1D10 Highly conductive deep eutectic solvents composed of organic salts and iodine
(Graduate School of Science, Chiba Univ.1,Ise Chemicals Corporation2) *Hideaki Shirota1, Maharoof Koyakkat1, Satoshi Asakura2, Hiroyuki Kawamoto2, Katsuhiko Moriyama1

Room E [Theory]

09:18-09:36
1E02 Theoretical studty of the core ionization energy
(Fukui Institute, Kyoto Univ.1,RIKEN2,Graduate School of Engineering, Nagasaki Univ.3) *Kimihiko Hirao1,2, Takahito Nakajima2, Bun Chan3,2
09:36-09:54
1E03 Exact density functionalization of the Kohn-Sham potential by using the density equation theory
(School of Science, The University of Tokyo1,Institute for Molecular Science2) *Kato Tsuyoshi1, Shinji Saito2
09:54-10:30
1E04 [Young Scientist Award Talk] Developments of analytic energy derivatives for accurate quantum chemical methods
(Graduate School of Science, Kyoto Univ.) *Yoshio Nishimoto
10:48-11:06
1E07 Progress of the Free Complement Theory for Solving the Schrödinger Equation
(Quantum Chemistry Research Institute) *Hiroshi Nakatsuji
11:06-11:24
1E08 Efficient Scheme of Exact Computations by Free Complement Theory
(Quantum Chemistry Research Institute) *Hiroyuki Nakashima, Hiroshi Nakatsuji
11:24-11:42
1E09 Development of first-principles GWΓ method
(Graduate School of Engineering, Shizuoka Univ.1,Graduate School of Engineering, Yokohama National Univ.2) *Kenta Yoneyama1, Yoshifumi Noguchi1, Kaoru Ohno2
11:42-12:00
1E10 Acceleration of two-component relativistic theory using element-based algorithm of local unitary transformation and parallel computing
(School of ASE, Waseda Univ.1,WISE, Waseda Univ.2) *Chinami Takashima1, Hiromi Nakai1,2

Wednesday Afternoon Sessions(September 18, starting at 15:15)

Room A [Gas phase]

15:15-15:33
1A11 Particle-exchange effects on atomic momentum distributions in molecules
(School of Science, Tokyo Tech.) *Sota Sakaguchi, Yasuhiro Ohshima, Masakazu Yamazaki
15:33-15:51
1A12 Observation of an electronic excitation transition with anormalously large intensity in electron back scattering
(IMRAM, Tohoku University1,University Se ́tif-12,Moscow State University3,Joint Inst. of Nuc. Res.4) *Satoru Kanaya1, Yuuki Onitsuka1, Salim Houamer2, Yuri Popov3,4, Masahiko Takahashi1
15:51-16:09
1A13 Spectroscopic observation of metastable He cluster cations (He)n+
(RIKEN1,Faculty of Science, Tokyo Metropolitan Univ.2,Univ. Southern California3,Graduate School of Science, Tohoku Univ.4,Mol. Photo., Kobo Univ.5,QST6) *Susumu Kuma1, Seiya Ohrui2,1, Amandeep Singh3, Mizuhiro Kominato4, James Harries6, Reika Kanya2, Asuka Fujii4, Masaaki Baba5,1, Andrey Vilesov3, Toshiyuki Azuma1
16:09-16:27
1A14 An (e, e+ion) spectroscopy study on the electron-impact dissociative ionization of SF6
(IMRAM, Tohoku Univ.) *Noboru Watanabe, Masahiko Takahashi
16:27-16:45
1A15 [Invited Talk] Ultrafast dynamics explored by laser-assisted electron scattering processes
(Faculty of Science, Tokyo Metropolitan Univ.) *Reika Kanya

Room B [Surface]

15:15-15:33
1B11 Gas-Liquid Interfaces of Aqueous Phenol Solutions Studied by Photoelectron Spectroscopy and Molecular Dynamics Simulation
(Graduate School of Science, Kyoto Univ.1,Graduate School of Science, Tohoku Univ.2,Graduate School of Science and Engineering, University of Toyama3) *Yo-ichi Yamamoto1, Tomonori Hirano2, Tatsuya Ishiyama3, Akihiro Morita2, Toshinori Suzuki1
15:33-15:51
1B12 Enantio-selective adsorption and catalytic activity of biomolecules at chiral amino acid-modified Au single crystalline electrodes
(Faculty of Env. Earth Sci., Hokkaido Univ.1,Graduate School of Env. Sci., Hokkaido Univ.2,Institute of Industrial Nanomater., Kumamoto Univ.3,Department of Mol. Pharmacology, National Cerebral and Cardiovascular Center4) *Ichizo Yagi1,2, Sayuki Oka2, Soichiro Yoshimoto3, Yuya Nishida4, Yasunori Shintani4, Masaru Kato1,2
15:51-16:09
1B13 Operando photoelectron spectroscopy of electrochemical CO2 reduction
(Graduate School of Science, Kyoto Univ.1,JASRI2,QST3,IMS4) *Takanori Koitaya1, Yasumasa Takagi2, Kohei Yamamoto3, Naoya Kurahashi4, Naoyuki Maejima4, Toshihiko Yokoyama4
16:09-16:27
1B14 SERS observation of potential-induced chemical and terahertz responses at ionic liquid/electrode interfaces
(Nagoya Inst. Tech.) *Katsuyoshi Ikeda
16:27-16:45
1B15 Effect of hydrophilic/hydrophobic cations on the initial surface oxidation of Pt(111) electrode
(Graduate School of Enginnering, Chiba Univ.1,JASRI/SPring-82) Tomoaki Kumeda1, Kenshin Kondo1, Syunnosuke Tanaka1, Osami Sakata2, Nagahiro Hoshi1, *Masashi Nakamura1
16:45-17:03
1B16 Ion size effect on excess potential for ion desorption at ionic liquid/electrode interface
(Department of Materials Science and Engineering, Tokyo Tech.1,Department of Chemistry, Shanghai Univ.2,Department of Physics, Sogang Univ.3) *Takashi Iwahashi1, Wei Zhou2, Doseok Kim3, Yukio Ouchi1

Room C [Clusters]

15:15-15:33
1C11 Dynamic structural analysis of the dynamic structure of metal clusters by combining direct observation of atomic dynamics using electron microscopy and quantum chemical calculation
(Laboratory for Chemistry and Life Science; Institute of Innovative Research, Tokyo Institute of Technology) *Masataka Yoshida, Ryo Oguro, Takane Imaoka, Kimihisa Yamamoto
15:33-15:51
1C12 Development of three-stage ion lens for cold ion-trap gas-phase spectrometer and application to ligand-protected metal clusters
(Grad. Sch. Adv. Sci. Eng., Hiroshia Univ.) *Minehiro Shikata, Masahiro Koyama, Satoru Muramatsu, Yoshiya Inokuchi
15:51-16:09
1C13 Gas-phase reactions of size-selected iron-oxide cluster cations with methane in the context of chemical processes in Mars’ atmosphere
(Faculty of Science, Kyushu Univ.1,ELSI, Tokyo Institute of Technology2) *Masashi Arakawa1, Satoshi Kono1, Yasuhito Sekine2, Akira Terasaki1
16:09-16:27
1C14 Oxidative reactivity and physical properties of Ni-atom encapsulating Si cage nanoclusters on organic substrate
(Faculty of science and technology, Keio Univ.) *Ayaka Sasaki, Takumi Ichikawa, Yugo Osada, Tsugunosuke Masubuchi, Atsushi Nakajima
16:27-16:45
1C15 Manipulating electrocatalytic response by deposition energy control: oxygen reduction reaction on graphite-supported sub-nano platinum clusters
(Department of Chemistry, Faculty of Science and Technology, Keio Univ.1,Department of Chemistry, Univ. of Utah2,Center for Functional Nanomaterials, Brookhaven National Laboratory3,Nanofab, Univ. of Utah4) *Tsugunosuke Masubuchi1,2, Sooyeon Hwang3, Paulo Perez4, Michael O'brien2, Scott Anderson2, Atsushi Nakajima1
16:45-17:03
1C16 Fabrication of nanopatterned structures on perylene single crystal by electron beam irradiation and their optical characterization
(Waseda University1,Institute for Molecular Science2) *Ken Morita1, Hiromi Okamoto1,2, Kohei Imura1

Room D [Biomolecules]

15:15-15:33
1D11 Selective IR images of keratin proteins in human nail by IR super-resolution microscopies based on non-linear optical process
(Faculty of Science, Okayama Univ. of Sci.1,Graduate School of Science and Engineering, Okayama Univ. of Sci.2) *Hirona Takahashi1,2, Ayaka Nagaoka2, Makoto Sakai1,2
15:33-15:51
1D12 Two-dimensional fluorescence lifetime correlation spectroscopy on single DNA molecules trapped in anti-Brownian electrokinetic trap
(Mol. Spectrosc. Lab., RIKEN1,RAP, RIKEN2,Dept. Chem., UW-Madison3) *Kunihiko Ishii1,2, Alexander Foote3, Brendan Cullinane3, Tahei Tahara1,2, Randall Goldsmith3
15:51-16:09
1D13 Structure and kinetics of E22G Aβ40 fibrils illuminate how Aβ40 rather than Aβ42 can trigger familial Alzheimer’s
(School of Life Science and Technology, Tokyo Institute of Technology1,RIKEN Center for Biosystems Dynamics Research, RIKEN2,RIKEN Center for Sustainable Resource Science, RIKEN3,Department of Chemistry, University of Illinois at Chicago4) Mohammad Jafar tehrani1, Matsuda Isamu1, Atsushi Yamagata2, Yu Kodama1, Tatsuya Matsunaga1,2, Mayuko Sato3, Kiminori Toyooka3, Dan Mcelheny4, Naohiro Kobayashi2, Mikako Shirouzu2, *Yoshitaka Ishii1,2
16:09-16:27
1D14 Estimation of free-energy differences in the H-bonds of protein environment
(Graduate School of Engineering, Univ. Tokyo1,RCAST, Univ. Tokyo2) *Masaki Tsujimura1, Keisuke Saito1,2, Hiroshi Ishikita1,2
16:27-16:45
1D15 Structural analysis of proteins in the gas phase using coarse-grained molecular dynamics simulation
(NMIJ, AIST1,Grad. Sch. of Med. Life Sci., Yokohama City Univ.2,Sch. of Pharm. Sci., Univ. of Shizuoka3) Kazumi Saikusa1,2, Satoko Akashi2, *Sotaro Fuchigami3
16:45-17:03
1D16 Molecular mechanism of the non-radiative decay of natural sunscreen compounds, mycosporine-like amino acids
(Sanyo-Onoda City Univ.1,Kumamoto Univ.2) *Makoto Hatakeyama1, Shinichiro Nakamura2

Room E [Theory]

15:15-15:51
1E11 [Invited Talk] Computational chemistry with external force for investigation of reaction mechanisms
(ICAT, Hokkaido Univ.1,IRC3, AIST2) *Jun-ya Hasegawa1,2
15:51-16:09
1E13 Molecular mechanism of the solubility changes induced by light irradiation in diarylethene derivatives
(Graduate school of Science Technology, Kumamoto Univ.1,Laboratory for Data Science, Priority Organization for Innovation and Excellence, Kumamoto Univ.2) *Masato Nakamura1, Yuki Harada2, Junwei Shen2, Ryoma Ohtani1, Satoshi Watanabe1, Tsuyoshi Fukaminato1, Shinichiro Nakamura2
16:09-16:27
1E14 Theoretical study on singlet fission dynamics in a symmetric trimer model with triplet acceptor molecules
(Graduate School of Engineering Science, Osaka Univ.1,Research Center for Solar Energy Chemistry, Osaka Univ.2,Center for Quantum Information and Quantum Biology, Osaka Univ.3,Innovative Catalysis Science Division, Institute for Open and Transdisciplinary Reseach Initiatives, Osaka Univ.4,Spintronics Research Network Division, Institute for Open and Transdisciplinary Research Initiatives, Osaka Univ.5) *Hajime Miyamoto1, Kenji Okada1, Kohei Tada1,2, Ryohei Kishi1,2,3,4, Yasutaka Kitagawa1,2,3,4,5
16:27-16:45
1E15 DFT study of nitrate reduction using rhenium complex and methane
(IMCE, Kyushu Univ.1,Grad. Sch. Eng., Kyushu Univ.2,FIFC, Kyoto Univ.3,WPI-I2CNER, Kyushu Univ.4) *Yohei Kametani1, Genta Nakamura2, Yoshihito Shiota1, Kazunari Yoshizawa3, Seiji Ogo2,4, Takahiro Matsumoto2,4
16:45-17:03
1E16 A theoretical investigation into multi-metal alloyed pentanuclear complexes
(Department of Chemistry, School of Science, Nagoya University1,Department of Chemistry, Graduate School of Science, Nagoya University2,Institute of Transformative Bio-Molecules (WPI-ITbM), Nagoya University3,Department of Chemistry, School of Science, Tokyo Institute of Technology4,Division of Applied Chemistry, Graduate School of Engineering, Osaka University5) *Vic Austen1, Quan Phung2,3, Takeshi Yanai2,3, Mio Kondo4, Shigeyuki Masaoka5