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

Poster Sessions

Thursday, September 19 (13:30 - 15:05)

The number before P in the Presentation Number indicates whether the poster presentation is given on the 1st, 2nd, 3rd, or 4th day of the meeting.

Room P

[Gas phase]

13:30-15:05
2P001 Microwave spectroscopy of CH2Cl2 in the ground stater and v4=1 vibrational excited state
(Graduate School of Science and Technology, Univ. Toyama1,University of Wisconsin-Madison2) *Manamu Kobayashi1, Kaori Kobayashi1, Brian j Esselman2, R. claude Woods2, Robert j. Mcmahon2
13:30-15:05
2P002 Development of gas-phase ion fluorescence spectrometer using relay lens optics system
(Grad. Sch. of Sci., Gakushuin Univ.) *Kenichi Okutsu, Kaoru Akazawa, Jun-ya Kohno
13:30-15:05
2P003 Photoelectron-photoion coincidence imaging spectroscopy of the ionization of CH4 in intense femtosecond laser fields
(School of Science, Tokyo Institute of Technology) *Naoto Hirabayashi, Taiki Kimura, Yasuhiro Ohshima, Masakazu Yamazaki
13:30-15:05
2P004 Quasi-Stationary Floquet Approach to Laser-Assisted Electron Scattering
(Graduate School of Science, Tokyo Metropolitan Univ.1,College of Science and Technology, Nihon Univ.2) *Kenya Nomura1, Tokuei Sako2, Reika Kanya1
13:30-15:05
2P005 Measurements of ion-molecule reactions of NO+ and hydrocarbons using photoionization and pulsed discharge ionization methods
(Grad. Sch. Adv. Sci. Eng., Hiroshima Univ.) *Taro Sakuda, Hinata Miyake, Keigo Nakayama, Katsuyoshi Yamasaki, Hiroshi Kohguchi
13:30-15:05
2P006 Ultrafast Ring-Opening Reaction of α-Phellandrene Stimulated by Impulsive Excitation of Molecular Vibrations Studied by Time-Resolved Photoelectron Spectroscopy
(Department of Applied Physics, Faculty of Engineering, Hokkaido Univ.1,Department of Chemistry, Faculty of Science, Hokkaido Univ.2,Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.3,Institute for Chemical Reaction Design and Discovery (WPI-ICReDD), Hokkaido Univ.4) *Zhiyi Zhou1, Kenichiro Saita2, Yusuke Minegishi3, Tetsuya Taketsugu2,4, Taro Sekikawa1
13:30-15:05
2P007 Cold ion trap infrared spectroscopy of alkali metal complexes of K+ channel mimics
(School of Science, Tokyo Tech1,University of Illinois at Urbana-Champaign2,Laboratory for Chemistry and Life Science, Tokyo Tech3,International Research Frontiers Initiative (IRFI), Tokyo Tech4,Research and Development Initiative, Chuo University5) *Riku Ishibashi1, Keisuke Hirata1, James Lisy2,4, Masaaki Fujii3,4,5, Shun-ichi Ishiuchi1
13:30-15:05
2P008 Observation of dissociative multiple-ionization ofCH3I and CH2I2 by Auger electron-ion coincidence spectroscopy
(Graduate School of Science, Nagoya University1,Institute of Liberal Arts and Sciences, University of Toyama2,Department of Applied Chemistry, Toyo University3,Research Center for Materials Science, Nagoya University4) *Mizuho Fushitani1, Yasumasa Hikosaka2, Motomichi Tashiro3, Akiyoshi Hishikawa1,4
13:30-15:05
2P009 Isolation of intermediates generated in Suzuki-Miyaura coupling solution for cold gas-phase spectroscopy
(Graduate School of Advanced Science and Engineering, Hiroshima Univ.) *Yuki Nakamura, Satoru Muramatsu, Yoshiya Inokuchi
13:30-15:05
2P010 Assignment of electronic spectrum of benzo(h)quinoline and structural determination of its hydrated cluster
(Graduate School of Science, Fukuoka Univ.) *Ryoka Kimura, Rintaro Hiyama, Yoshinori Nibu, Yuji Yamada
13:30-15:05
2P011 Mechanisms of intramolecular long-range proton transfer reactions in protonated aminonaphthoic acid studied by ion mobility-mass spectrometry
(Graduate School of Science, Tohoku Univ.) *Daiki Fuse, Kengo Tsunoda, Keijiro Ohshimo, Fuminori Misaizu
13:30-15:05
2P012 Electron rescollisional excitation of OCS+ in phase-locked two-color intense laser fields
(KPSI-QST) *Tomoyuki Endo, Tomohito Otobe, Ryuji Itakura
13:30-15:05
2P013 Effect of buffer gas on the cooling process of hydrated phenol cations
(School of Science, Kitasato Univ.1,Graduate School of Science, Kitasato Univ.2) *Yuina Hoshi1, Yu Sakaue2, Haruki Ishikawa1
13:30-15:05
2P014 Observation of fine structure in standing striations and its control in DC glow discharge dusty plasmas
(Faculty of Arts and Science, Kyushu Univ.1,Interdisciplinary Graduate School of Engineering Sciences, Kyushu Univ.2) *Kenji Furuya1,2

[Clusters]

13:30-15:05
2P015 Dramatic Improvement of Near-Infrared Emission and Triplet Sensitization Properties of Ag15Cu12 Clusters by Ligand Exchange
(Rikkyo Univ.) *Daichi Arima, Masaaki Mitsui
13:30-15:05
2P016 The synthesis and growth mechanism of core-shell type alloy nanoparticles with various core/shell ratios using Au and Ag nanoclusters as starting materials
(Graduate School of Science, Chiba Univ.1,Graduate School of Engineering, Utsunomiya Univ.2) *Kazuki Umeda1, Nobuo Uehara2, Yuhi Suzuki2, Takeshi Morita1
13:30-15:05
2P017 Collision induced dissociation of cadmium -sulfide cluster [Cd10S4(SPh)16]4– and fragment clusters: effect of SPh ligand
(Graduate School of Advanced Science and Engineering, Hiroshima Univ.1,Institute for Chemical Research, Kyoto Univ.2) *Keisuke Yukawa1, Satoru Muramatsu1, Ryo Takahata2, Toshiharu Teranishi2, Yoshiya Inokuchi1
13:30-15:05
2P018 Change in the aggregation state and SERS intensity change of complexes formed by gold nanoparticles of varying sizes and functional polymers
(Graduate School of Science, Chiba Univ.1,Graduate School of Engineering, Utsunomiya Univ.2) *Shinya Tamura1, Nobuo Uehara2, Yuhi Suzuki2, Takeshi Morita1
13:30-15:05
2P019 Electron binding mechanism in the dimer of thiolate-protected MAu12 (M = Au, Pt) cluster
(Graduate School of Science, the University of Tokyo) *Yosuke Nakashima, Shun Ito, Kiichirou Koyasu, Tatsuya Tsukuda
13:30-15:05
2P020 Time-Resolved Analysis of Photon Upconversion Processes in Rare Earth Doped Nanoparticles
(Kyushu Univ.1,Teikyo Univ. of Science2,Waseda Univ.3) *Kiyoshi Miyata1, Kento Tatsui1, Shiori Miyazaki1, Mako Takada1, Kanji Sugioka1, Mitsunori Ohta2, Ryusuke Mizoguchi2, Ayumi Ishii3, Ken Onda1
13:30-15:05
2P021 Theoretical studies on the reaction mechanism of ammonia synthesis by lithium nitride phase
(Graduate School of Science, JWU1,Graduate School of Nanobioscience, YCU2) *Chinami Okamura1, Azusa Muraoka1, Koichi Yamashita2
13:30-15:05
2P022 Exploration of novel core structure for phosphine-protected Au clusters induced by association with Nb oxides clusters
(Graduate School of Science, Tokyo Metropolitan Univ.1,JST2) *Taishi Suzuki1, Tomoki Matsuyama1, Hideyuki Kawasoko1,2, Soichi Kikkawa1, Seiji Yamazoe1
13:30-15:05
2P023 Oxidation reactivity of single-sized cobalt nanoclusters on organic substrates
(Faculty of Science and Technology, Keio Univ.1,Technical University of Munich2) *Takashi Nishikawa1, Ryoichi Sato1, Anna Lemperle2, Tomoya Inoue1, Tsugunosuke Masubuchi1, Atsushi Nakajima1
13:30-15:05
2P024 Structural characterization of phosphine-protected gold clusters by high-field asymmetric waveform ion mobility spectrometry and photodissociation spectroscopy
(Hiroshima Univ.1,Wollongong Univ.2,The Univ. of Tokyo3) *Satoru Muramatsu1, Oisin Shiels2, Boris Ucur2, Brett Burns2, Shinjro Takano3, Tatsuya Tsukuda3, Adam Trevitt2, Yoshiya Inokuchi1
13:30-15:05
2P025 Synthesis of novel dithiolate co-protected Au24Pt alloy nanocluster and evaluation of their catalytic activity
(Graduate School of Science, Tokyo Univ. of Science1,Institute of Multidisciplinary Research for Advanced Materials, Tohoku Univ.2) *Miyu Sera1, Sara Yoshikawa1, Kana Takemae1, Sakiat Hossain1, Yoshiki Niihori1, Tokuhisa Kawawaki1, Yuichi Negishi1,2
13:30-15:05
2P026 Intercalation of Nb/Ta oxide clusters into MgAl-based layered double hydroxides
(Graduate School of Science, Tokyo Metropolitan Univ.1,JST PRESTO2) *Koyo Takahshi1, Hideyuki Kawasoko1,2, Soichi Kikkawa1, Seiji Yamazoe1
13:30-15:05
2P027 Advanced synthesis of alloy nanoclusters using ultra fine microreactors
(Fac. Sci. Keio Univ.1,Shibaura Machine Co., Ltd., Japan2) *Kurinosuke Moriyama1, Hidenari Takemoto1, Kenji Urabe1, Katsutoshi Tanaka2, Tsugunosuke Masubuchi1, Atsushi Nakajima1

[Solid phase]

13:30-15:05
2P028 Synthesis of metal dithiolene complexes bearing photochromic molecules for the development of photoresponsive molecular conductors
(College of Science, Rikkyo University) *Kaito Wakao, So Yokomori, Ryo Nishimura, Masakazu Morimoto, Nobuyuki Matsushita
13:30-15:05
2P029 Evaluation of structure and physical properties of a radical cation salt with BEDO-TTF and magnetic anion
(Graduate School of Science, Tokyo University of Science1,Faculty Science of Division 1, Tokyo University of Science2) *Shinnosuke Hosaka1, Takuya Kanetomo2, Masaya Enomoto2
13:30-15:05
2P030 Structures and Physical Properties of 2-(p-Benzoquinonyl)benzothiazol Derivatives and Their Charge Transfer Complexes
(Graduate School of Engineering, Tohoku University1,IMRAM, Tohoku University2,Chitose Institute of Science and Technology3) *Toshitaka Tsushima1, Shun Dekura1,2, Tetsu Sato1,2, Ken-ichi Sakai3, Tomoyuki Akutagawa1,2
13:30-15:05
2P031 Low-frequency Raman microspectroscopy of photomechanical crystals: tracking of hierarchical photoresponse by observation of molecular and lattice vibrations of the photoproduct
(Graduate School of Engineering Science, Osaka University1,Graduate School of Engineering, Osaka Metropolitan University2) *Shin Ozamoto1, Hikaru Sotome1, Kohei Morimoto2, Rei Tomoda2, Daichi Kitagawa2, Seiya Kobatake2, Hiroshi Miyasaka1
13:30-15:05
2P032 Electron localization induced by disordered anions in κ"-(ET)2Cu[N(CN)2]Br
(Graduate School of Science, Kyoto Univ.1,Graduate School of Engineering, Nagoya Univ.2,JASRI3) *Soichiro Yasaka1, Yukihiro Yoshida1, Yuki Tanaka1, Yuto Nakamura2, Hideo Kishida2, Yuiga Nakamura3, Hiroshi Kitagawa1, Mitsuhiko Maesato1
13:30-15:05
2P033 Development of Azopolymer-Based Electrode Materials for Rechargeable Batteries
(Graduate School of Science and Technology, Kwansei Gakuin Univ.1,Graduate School of Engineering, Kwansei Gakuin Univ.2) *Yudai Aoi1, Ryo Matsushima1, Katsuhiro Wakamatsu2, Hirofumi Yoshikawa2
13:30-15:05
2P034 Structure and physical properties of metal-free perovskite-type molecular crystal using phosphorus-containing heterocyclic compound
(Graduate School of Sciences and Technology for Innovation, Yamaguchi University1,Graduate School of Engineering, Tohoku University2,IMRAM, Tohoku University3) *Yumi Matsuda1, Rentaro Asai1, Atsuko Masuya-suzuki1, Tomoyuki Akutagawa2,3, Ryo Tsunashima1
13:30-15:05
2P035 Observation of electronic structure of 18crown6/acetonitrile/ metal salt crystals by soft x-ray absorption spectroscopy
(Graduate School of Sciences and Technology for Innovation, Yamaguchi univ.1,RIKEN RSC2,Graduate School of Advanced Science and Engineering, Hiroshima univ.3) *Yuki Shiro1,2, Osamu Takahashi3,2, Masaki Oura2, Yuka Horikawa1,2
13:30-15:05
2P036 Shear stress effect on ring-opening reaction of naphthospiropyran
(Graduate School of Engineering, Sanyo-Onoda Ctiy Univ.1,Faculty of Engineering, Sanyo-Onoda Ctiy Univ.2) *Yukiko Ohtani1, Nobutsugu Hamamoto2, Makoto Inokuchi1,2
13:30-15:05
2P037 Observation of toroidal moments in a chiral triangular lattice antiferromagnet
(Graduate School of Adv. Sci. and Eng., Hiroshima Univ.1,CResCent, Hiroshima Univ.2,WPI-SKCM2, Hiroshima Univ.3,PRESTO, JST4) *Yuki Kato1, Sadahumi Nishihara1,2,4, Katsuya Inoue1,2,3
13:30-15:05
2P038 Synthesis and thermal properties of organometallic ionic plastic crystals with cyanoborate anions
(Graduate school of Science, Kobe Univ.1,Research Center for Membrane and Film Technology2) *Ryota Inoue1, Haruka Koshino1, Masato Shimada1, Tomoyuki Mochida1,2
13:30-15:05
2P039 Theoretical studies on electronic properties and magnetic interactions in Cubane-type Mn trinuclear complex (YMn3O3, DyMn3O3)
(RIKEN R-CCS1,Osaka Univ.2,Univ. Tsukuba3,Osaka Univ.4) *Takashi Kawakami1,2, Mizuki Otsuka2, Koichi Miyagawa3,4, Shusuke Yamanaka2, Mitsutaka Okumura2, Takahito Nakajima1, Kizashi Yamaguchi1,4
13:30-15:05
2P040 Excitation wavelength-dependent emission spectral changes in mixed crystals of Tb and Eu complexes showing antenna effects via multiple triplet states
(Graduate School of Sciences and Technology for Innovation, Yamaguchi Univ.) *Maki Tatehara, Atsuko Suzuki, Ryo Tsunashima
13:30-15:05
2P041 Synthesis of a novel donor-acceptor molecular assembly composed by Rh binuclear unit with a bulky dicarboxylic acid ligand and an electron acceptor molecule
(Graduate School of Science, Tokyo University of Science.) *Fuminori Kimura, Kazuya Otsubo
13:30-15:05
2P042 Synthesis and properties of tetrahedral iron complex(C72H72Fe4O60) and its analogs
(Grad. Sch. Adv. Sci. Eng., Hiroshima Univ.1,Grad. Sch. Sci. Tech., Yamaguchi Univ.2,CResCent3,WPI-SKCM24,PRESTO, JST5) *Hina Matsumoto1, Chisato Kato1, Jun Manabe1, Daiki Matsumoto2, Ryo Tsunashima2, Katsuya Inoue1,3,4, Sadafumi Nishihara1,3,5
13:30-15:05
2P043 Layer number dependence of phonon modes in MoTe2 thin films
(NAIST1,QST Takasaki2,QST Kansai3) *Hikaru Takako1, Honoka Ueki1, Garrek Stemo1, Tomoyuki Endo3, Seiji Sakai2, Ryuji Itakura3, Hiroyuki Katsuki1
13:30-15:05
2P044 Study on magnetic phase transition in van der Waals magnetic material with controlled dimensionality through molecular intercalation
(Kyoto Univ.1,JST-FOREST2) *Yuki Nakano1, Ichiro Oya1, Shu Seki1, Masayuki Suda1,2
13:30-15:05
2P045 Time-resolved emission imaging of thermally activated delayed fluorescence material: real-space evaluation of exciton diffusion dynamics in amorphous films
(Graduate School of Engineering Science, Osaka University1,Institute for Chemical Research, Kyoto University2) *Hidenori Yoneda1, Hikaru Sotome1, Yuka Yasuda2, Ryosuke Okumura2, Syoji Ito1, Hironori Kaji2, Hiroshi Miyasaka1
13:30-15:05
2P046 Construction of UV HR microspectroscopy system using visible light as excitation light
(Graduate School of Arts and Sciences, University of Tokyo) *Kouichirou Nakazono, Masanari Okuno

[Surface]

13:30-15:05
2P047 Operando measurements of multilayered organic light-emitting diodes using electronic sum-frequency generation spectroscopy
(Graduate School of Engineering, Chiba Univ.) *Tatsuya Kaburagi, Kazunori Morimoto, Takayuki Miyamae
13:30-15:05
2P048 Molecular dynamics study on the structure at a polymer brush/water interface
(Graduate School of Science and Engineering, University of Toyama) *Nanaka Yamamoto, Tatsuya Ishiyama
13:30-15:05
2P049 Hydrogen evolution reaction on cobalt complex modified Au electrodes
(Graduate School of Engineering, Nagoya Institute of Technology) *Atsuki Ikemata, Kenta Motobayashi, Katsuyoshi Ikeda
13:30-15:05
2P050 Development of a sample holder to study the surface chemistry of interstellar silicate grains
(Komaba Institute for Science, UTokyo) *Tetsuya Hama, Atsuki Ishibashi
13:30-15:05
2P051 Electronic structure of lipids in lipid bilayers using attenuated total reflection far-ultraviolet and Raman spectroscopy.
(Graduate School of Science and Engineering,Kindai University) *Yoshiki Hanjo, Yusuke Morisawa
13:30-15:05
2P052 [Withdraw]
13:30-15:05
2P053 Oil/Water Interface in Solvent Extraction of Lanthanide Ions Studied Using Vibrational Sum Frequency Generation Spectroscopy
(Japan Atomic Energy Agency1,Graduate School of Science and Engineering Major in Applied Beam Science2) *Noa Nakai1,2, Shuhei Urashima1, Masayuki Watanabe1, Ryoji Kusaka1
13:30-15:05
2P054 Development and examination of comprehensive theory for local field in sum frequency generation spectroscopy
(Graduate School of Science, Tohoku Univ.) *Tomonori Hirano, Akihiro Morita

[Liquid phase]

13:30-15:05
2P055 Ultrafast pump-probe spectroscopy of ammonium thiocyanate under vibrational strong coupling
(Nara Institute of Science and Technology, Graduate School of Science and Technology, Division of Materials Science, Quantum Photo-Science Laboratory) *Avram Gutierrez, Garrek Stemo, Joel Nishiuchi, Hiroyuki Katsuki
13:30-15:05
2P056 Electrolytes dissolved in liquid alcohols: a photoelectron spectroscopic study using He(II) radiation
(Graduate School of Science, Kyoto Univ.) Stephan Thuermer, *Mikihisa Aotani, Toshinori Suzuki
13:30-15:05
2P057 How to find the component of hydration water embedded in the soft X-ray absorption spectra of aqueous solutions
(Graduate School of Advanced Science and Engineering, Hiroshima Univ.1,UVSOR Facility, Institute for Molecular Science2,The Graduate Univ. for Advanced Studies3) *Chika Sugahara1, Hiroshi Iwayama2,3, Kazumasa Okada1
13:30-15:05
2P058 Unexpected high-pressure phase behavior of methylated imidazolium-based ionic liquids and their local structural changes
(Department of Applied Chemistry, National Defense Academy) *Hiroki Wakatsuki, Atsushi Yamada, Takahiro Takekiyo, Yukihiro Yoshimura
13:30-15:05
2P059 Two liquid states of helium-4 obeying Boltzmann statistics: existence of non-superfluid freezing by heating
(Graduate School of Humanities and Sciences, Nara Women's University) *Kenichi Kinugawa, Momoko Tsujimoto
13:30-15:05
2P060 Low-Frequency Spectra of Amide-Lithium Salt Deep Eutectic Solvents
(Department of Chemistry, Chiba University) *Maharoof Koyakkat, Hideaki Shirota
13:30-15:05
2P061 Excitation relaxation processes and pH dependence of 5-fluoro-4-thiouridine derivatives
(College of Science and Engineering, Aoyama Gakuin University) *Yuki Ambe, Rin Sato, Wataru Kashihara, Tadashi Suzuki
13:30-15:05
2P062 Purification of unsaturated fatty acid by recrystallization method and ultraviolet absorption spectra
(Graduate School of Arts and Sciences, The Univ. of Tokyo1,Faculty of Pure and Applied Sciences, Univ. of Tsukuba2) *Shota Saito1, Raiki Nishizawa1, Naoki Numadate2, Tetsuya Hama1
13:30-15:05
2P063 Dynamic Light Scattering (DLS) Measurements of Whiskey Liquids using Colloidal Particles as Probes
(CHS,Nihon Univ.) *Hisui Masumura, Ken Judai, Taichi Ogawa

[Biomolecules]

13:30-15:05
2P064 A microbial rhodopsin functionally converted by a single amino acid substitution: comparison of retinal chromophore structures
(Graduate School of Science, Osaka Univ.) *Futa Nishimori, Taito Urui, Yasuhisa Mizutani
13:30-15:05
2P065 Temporal and spatial fluctuations of viscosity in single vesicle lipid bilayer membranes of DOPC, DPPC and DMPC observed by picosecond time-resolved fluorescence microspectroscopy
(Department of Chemistry, Faculty of Science, Gakushuin University) *Mizuki Watanabe, Koichi Iwata
13:30-15:05
2P066 Control of the orientation of SRII-HtrII complex from Natronomonas pharaonis and analysis of their light-induced structural change by surface-enhanced infrared spectroscopy
(Graduate School of Science, NITech1,OptoBioTechnology Research Center, NITech2) *Tatsuya Sakamoto1, Jingyi Tang1, Soichiro Kato1, Tatsuro Nishikino1,2, Yuji Furutani1,2
13:30-15:05
2P067 Experimental and theoretical study for absorption- fluorescence-, and bioluminescence properties of seMpai
(Graduate School of Science and Technology, Gunma Univ.1,ISSP, Univ. Tokyo2,Department of Applied Chemistry and Biochemical Engineering, Graduate School of Engineering, Shizuoka Univ.3,Department of Engineering Science, Graduate School of Informatics and Engineering, The University of Electro-Communications4,Center for Neuroscience and Biomedical Engineering (CNBE), The University of Electro-Communications5,Department of Chemical and Biological Sciences, Faculty of Science , Japan Woman’s Univ.6,School of Pharmacy,Tokyo University of Pharmacy and Life Sciences7,Gunma University Center for Food Science and Wellness8) Masahiro Harada1, Ryohei Ono1,2, Tamotsu Uchiyama1, Yoshifumi Noguchi3, Ryohei Saito-moriya4,5,6, Hiroshi Aoyama7, Nobuo Kitada4,5, Shojiro Maki4,5, Takashi Hirano4, Masataka Kobayashi2, Hidefumi Akiyama2, Hideyuki Itabashi1,8, *Miyabi Hiyama1,8
13:30-15:05
2P068 Label-free quantitative analysis of ALS-related protein-RNA interactions in a liquid droplet formed by liquid-liquid phase separation
(Faculty of Pharmaceutical Sciences, Tohoku Univ.1,Graduate School of Pharmaceutical Sciences, Tohoku Univ.2) *Taisei Ogura1, Uchu Matsuura2, Shinya Tahara1,2, Shinji Kajimoto1,2, Takakazu Nakabayashi1,2
13:30-15:05
2P069 Cytotoxicity and solution properties of ionic liquids for HEK293 cells
(Department of Applied Chemistry, National Defense Academy) *Masaharu Nakayama, Atsushi Yamada, Takamasa Uekita, Takahiro Takekiyo, Yukihiro Yoshimura
13:30-15:05
2P070 Opto-control of protein-protein interactions by utilizing photosensor eBLUF
(Graduate School of Science, Kyoto Univ.1,Graduate School of Biostudies, Kyoto Univ.2) *Takafumi Kuno1, Yusuke Nakasone1, Kazuhiro Sakamaki2, Masahide Terazima1
13:30-15:05
2P071 Attempt to observe chemical reactions of a single enzyme molecule by two-dimensional fluorescence lifetime correlation spectroscopy
(Molecular Spectroscopy Laboratory, RIKEN, Japan1,Molecular Physiology Laboratory, RIKEN, Japan2,RIKEN Center for Advanced Photonics, Japan3) *Tsukasa Tokita1, Hajime Shinoda2, Kunihiko Ishii1,3, Rikiya Watanabe2, Tahei Tahara1,3
13:30-15:05
2P072 Fluorescence spectrum of inclusion complex of curcumin and ferulic acid with hydroxypropyl-β-cyclodextrin
(Faculty of Pharmaceutical Sciences,Tokyo Univ. of Science) *Koyuki Kokawa, Ryotaro Koga, Chihiro Kuroda, Tomohiro Tsuchida, Satoru Goto

[Theory]

13:30-15:05
2P073 Theoretical study on ultrafast relaxation dynamics involving excited state intramolecular proton transfer of ortho-nitrophenol
(Faculty of Science, Hokkaido Univ.1,WPI-ICReDD, Hokkaido Univ.2) *Satoi Wada1, Tetsuya Taketsugu1,2
13:30-15:05
2P074 Theoretical study on the motion of Li+ confined in metallic and semiconducting carbon nanotubes
(Graduate School of Science and Engineering, Yamagata Univ.) *Akari Hangai, Hideo Ando
13:30-15:05
2P075 Theoretical Study on the Photo-Excited States of Diradical Systems Using Multireference Theory
(Graduate School of Science, Kyoto Univ.) *Kazuki Yanai, Yuki Kurashige
13:30-15:05
2P076 Long-time dynamics analysis of ZnO/water interface using reactive molecular dynamics simulation
(Graduate School of Engineering, The University of Tokyo) *Tori Kakegawa, Tatsushi Ikeda, Akira Nakayama
13:30-15:05
2P077 Ab initio Study of The Electron Spin Relaxation of The Triplet State of Oligoacenes
(Graduate School of Science, Kyoto Univ.) *Katsuki Miyokawa, Yuki Kurashige
13:30-15:05
2P078 Elucidation of Complicated Reaction Path Networks in Hydrolysis of Titanium Aqua Complexes Using Automated Reaction Path Search Method
(IMCE, Kyushu Univ.1,Yamaguchi Univ.2) *Ryoga Toyoshima1, Yoshihito Shiota1, Yosuke Sumiya2
13:30-15:05
2P079 Study of UV Spectral Calculations Using the State-Specific Method
(KYOCERA) *Takako Mashiko, Mizuho Kurosaki, Chihiro Takeshita
13:30-15:05
2P080 Study on the generation mechanism of stacking direction component of magnetically-induced currents in π-dimers of antiaromatic molecules
(Graduate School of Engineering Science, Osaka University,1,QIQB, Osaka University2,ICS-OTRI, Osaka University3,SRN-OTRI, Osaka University4) *Ryota Sugimori1, Ryohei Kishi1,2,3, Kohei Tada1, Yasutaka Kitagawa1,2,3,4
13:30-15:05
2P081 Theoretical study of reduction of NO to N2O by copper complex
(Kyushu Univ.1,Kyoto Univ.2) *Yoshihito Shiota1, Ryoga Toyoshima1, Yohei Kametani1, Kazunari Yoshizawa2
13:30-15:05
2P082 Analysis of relevance between reaction path bifurcation and electron transfer utilizing natural reaction orbital
(Grad. Sch. Chem. Sci. Eng., Hokkaido Univ.1,WPI-ICReDD, Hokkaido Univ.2,Fac. Sci., Hokkaido Univ.3) *Tatsuhiro Nakanishi1, Yuriko Ono2, Takuro Tsutsumi3, Kazuki Sada3, Tetsuya Taketsugu2,3
13:30-15:05
2P083 Molecular collision theory including quantum effects such as tunneling effect, development of simulation programs using it, and application to N+H_3^+ collision reactions in interstellar space
(Graduate School of Science and Technology, Sohia Univ.) *Hayato Otsubo
13:30-15:05
2P084 Efficiently estimate pure tunnel probability Development of semi-classical dynamics theory
(Graduate School of Science and Technology, Sophia University) *Keitaro Nagai
13:30-15:05
2P085 Application of density functional tight-binding schemes for high-throughput screening of dye molecules in dye-sensitized solar cell
(WISE, Waseda Univ.1,School of Advanced Science and Engineering, Waseda Univ.2,Department of Chemistry and Biotechnology, SUT Australia3) *Mikito Fujinami1, Iori Shimizu2, Feng Wang3, Hiromi Nakai1,2
13:30-15:05
2P086 Location of the Shared Proton in Proton-Bound Dimer Compound of Hydrogen Sulfate and Formate: Path Integral Molecular Dynamics Study
(Gifu Univ.1,Tokyo Tech.2,Yokohama City Univ.3) *Taro Udagawa1, Hikaru Tanaka1, Kazuaki Kuwahata2, Masanori Tachikawa3
13:30-15:05
2P087 Study of electronic structure of adamantane in condensed phase by far-ultraviolet spectroscopy
(Graduate School of Science and Engineering, Kindai Univ.) *Tomoyuki Komoto, Yusuke Morisawa
13:30-15:05
2P088 Analysis of membrane permeability of ibuprofen and aspirin by using a free energy reaction route network method
(Graduate School of Science, OMU1,RIMED, OMU2) *Yoshiki Hida1, Yuki Mitsuta1,2, Toshio Asada1,2
13:30-15:05
2P089 Theoretical study on an enzymatic reaction of the hammerhead ribozyme
(Graduate School of Science, Kyoto Univ.1,IMRAM, Tohoku Univ.2) *Ayaka Matsuyama1, Masahiko Taguchi2, Shigehiko Hayashi1
13:30-15:05
2P090 Theoretical study on the formation reaction of naphthalene in toluene/acetylene plasma
(Graduate School of Engineering, Chiba Inst. of Tech.) *Mizuki Nagafuji, Shoji Kudo, Hidenori Matsuzawa
13:30-15:05
2P091 First-principles study of ethylene acrylic acid adhesion to Cr2O3 surface
(Undergraduate School of Engineering, Kyushu Univ.1,Interdisciplinary Graduate School of Engineering Sciences, Kyushu Univ.2) *Hiroki Iwai1, Yuta Tsuji2
13:30-15:05
2P092 Structure of maleic and succinic acid in aqueous solution by soft X-ray absorption spectroscopy
(Graduate School of Advanced Science and Engineering, Hiroshima Univ.) *Risa Okada, Ryosuke Yamamura, Osamu Takahashi
13:30-15:05
2P093 A DFT Study of Driving Forces of Electrochemical Hydrogen Generation on N2P2-Ni(II)Complexes
(Graduate School of Engineering, Nagoya Inst. Tech.1,School of Regional Studies, Gifu. Univ.2,School of Engineering, Aichi Inst. Tech.3) *Yuko Wasada-tsutsui1, Hiroaki Wasada2, Hidenori Miyake1, Kenichi Nakao1, Takuma Kato1, Tomohiro Ozawa1, Hideki Masuda1,3
13:30-15:05
2P094 Developing a Conformational Sampling Method for Transition State Structures with Varying Reaction Centers
(Graduate School of Chemical Sciences and Engineering, Hokkaido Univ.1,WPI-ICReDD2,Graduate School of Science, Hokkaido Univ.3,JST-ERATO4) *Satoshi Matsutani1, Nobuya Tsuji2, Satoshi Maeda2,3,4
13:30-15:05
2P095 DFT Study of Ruthenium-Catalyzed Ammonia Oxidation Reaction
(Faculty of Pharmaceutical Sciences, Toho Univ.1,School of Engineering, Univ. of Tokyo2) *Ken Sakata1, Naomi Kanazawa1, Marin Nemoto1, Tasuku Yano1, Takeshi Yoshikawa1, Yoshiaki Nishibayashi2
13:30-15:05
2P096 Development of machine learning model for predicting laser parameters to fabricate optical diffusers
(Graduate School of Science, Tohoku Univ.1,Institute of Advanced Energy, Kyoto Univ.2) *Ryoma Kawaoto1, Tomotaro Namba1, Yukiyoshi Ohtsuki1, Feng Yan2, Takashi Nakajima2
13:30-15:05
2P097 Machine learning-based prediction of crystal phases in perovskite compounds
(Graduate School of Science and Technology, Kobe Univ) *Ryota Yamamoto, Kazutaka Nishiguchi, Seiichiro Ten-no
13:30-15:05
2P098 Resonance and non-resonance Raman scattering as a two-photon and one-phonon process in the crude adiabatic representation
(Fac. Eng., Kyoto Univ.1,Grad. Sch. Eng., Kyoto Univ.2,FIFC, Kyoto Univ.3) *Takumi Yagi1,3, Wataru Ota2,3, Naoki Haruta2,3, Tohru Sato2,3
13:30-15:05
2P099 Analysis of the geometric structure of metal and supported metal nanoparticles using first principles calculation
(Graduate School of Advanced Science and Engineering, Waseda Univ.1,MANA, NIMS2,WISE, Waseda Univ.3) *Miyu Onishi1, Ayako Nakata2, Hiromi Nakai1,3
13:30-15:05
2P100 Theoretical analysis of the molecular evolutionary mechanism of firefly bioluminescence
(Graduate School of Engineering, Chiba Institute of Technology.1,Faculty of Applied Biology, Chubu University.2,Faculty of Pharmacy, Wakayama Medical University.3) *Souta Obote1, Yuichi Oba2, Toru Nakatu3, Norifumi Yamamoto1
13:30-15:05
2P101 A machine learning approach for modeling and analyzing intra-molecular modes of water
(Graduate School of Science,Kyoto Univ1,Graduate School of Energy Science, Kyoto Univ2) *Kwanghee Park1, Juyeon Jo2, Yoshitaka Tanimura1
13:30-15:05
2P102 Structural analysis of nano-water droplets: A molecular dynamics study
(Graduate School of Advanced Science and Engineering, Hiroshima Univ.1,The Institute for Solid State Physics, The University of Tokyo2) *Nanami Shima1, Yoshihisa Harada2, Osamu Takahashi1
13:30-15:05
2P103 High-precision and high-efficiency prediction of intermolecular interaction energies using machine learning models trained on quantum chemical molecular information
(Graduate School of Medicine, Kyoto Univ.) *Yudai Kobayashi, Takao Otsuka, Yasushi Okuno
13:30-15:05
2P104 Theoretical study of reduction of NO to N2O by iron(II) complex
(IMCE, Kyushu Univ.) *Yu Furukawa, Yohei Kametani, Yoshihito Shiota
13:30-15:05
2P105 Verification of accelerated molecular dynamics method with atom resolved energies of quantum chemical computations
(WISE, Waseda University1,Sch. Adv. Sci. Eng, Waseda University2) *Yoshifumi Nishimura1, Hiromi Nakai1,2
13:30-15:05
2P106 Theoretical study on open-shell electronic structures of fused ring π-conjugated system involving azulene units
(Graduate School of Engineering Science, Osaka University1,RCSEC, Osaka University2,QIQB, Osaka University3,ICS-OTRI, Osaka University4,SRN-OTRI, Osaka University5) *Kaichi Shimada1, Kohei Tada1,2, Ryohei Kishi1,2,3,4, Yasutaka Kitagawa1,2,3,4,5
13:30-15:05
2P107 Stable structural analysis of palladium and nickel polynuclear complexes using DFT calculations
(Hyogo Prefectural Institute of Technology1,QunaSys Inc.2,Applied Chemistry Dept., Kobe City College of Technology3) *Masahiro Kouno1, Shota Takamuku2, Soichiro Nishio2, Yoshitaro Miyashita3
13:30-15:05
2P108 Symplectic integrator approach to propagation of light pulses in nonuniform dispersive media
(College of Sci. & Tech., Nihon Univ.) *Tokuei Sako
13:30-15:05
2P109 Theoretical analysis of cis-trans photoisomerization dynamics of lycopene
(Graduate School of Engineering, Chiba Institute of Technology.1,Meijo Univ2) *Naoya Miyakawa1, Masaki Honda2, Norifumi Yamamoto1