Friday, September 12
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.
- Room A Morning
- Room B Morning
- Room C Morning
- Room D Morning
- Room E Morning
- Room B Afternoon
- Room D Afternoon
- Room E Afternoon
Friday Morning Sessions(September 12, starting at 9:00)
Room A [Clusters]
09:18-09:36
| 4A02 | Semiclassical Truncated-Wigner-Approximation Theory of Molecular Exciton-Polariton Dynamics in Optical Cavities (Graduate School of Engineering, Kyoto University) *Thanh phuc Nguyen |
|---|
09:36-09:54
| 4A03 | Accurate reproduction of ionization energy and electron affinity of Al13 nanocluster via quantum Monte Carlo and vibronic analysis (Osaka University1,Keio University2) *Meliton iii romero Chiong1, Atsushi Nakajima2, Yoshitada Morikawa1 |
|---|
09:54-10:12
| 4A04 | Spatial characteristics of chiral optical fields enhanced near a single gold nanoplate (Faculty of Science and Engineering, Waseda University) Seiju Hasegawa, *Kohei Imura |
|---|
10:12-10:30
| 4A05 | DFT-based reconstruction of 3D structures and bonding analysis of alloy clusters observed in STEM images (CLS, Science Tokyo) *Masataka Yoshida, Takuma Harada, Noa Naiki, Takane Imaoka, Kimihisa Yamamoto |
|---|
10:48-11:06
| 4A07 | Evaluation of the structure of water molecular ensembles under vibrational strong coupling using infrared spectroscopy (Graduate School of Chemical Sciences and Engineering, Hokkaido University1,Faculty of Science, Hokkaido University2,JST-PRESTO3) *Nobuki Iwasa1, Naotoshi Miyasaka1, Lauren Takahashi2,3, Keisuke Takahashi2, Tomohiro Fukushima2,3, Masaki Itatani2, Kei Murakoshi2 |
|---|
11:06-11:24
| 4A08 | Incorporation of Heterometallic Dimers into Pyridyl-Modified Gold Clusters and Their Characterization (Faculty of Environmental Earth Science, Hokkaido Univ.1,Graduate School of Environmental Science, Hokkaido Univ.2,Faculty of Science, Tokyo Metropolitan Univ.3) *Yukatsu Shichibu1,2, Lan Xu2, Hiroto Morita2, Soichi Kikkawa3, Seiji Yamazoe3, Katsuaki Konishi1,2 |
|---|
11:24-11:42
| 4A09 | Precise control of ultra-small silicon nanocrystals: photoluminescence vs. size, crystallinity, and stress (Grad. Sch. Adv. Sci. Eng., Hiroshima Univ.1,N-BARD, Hiroshima Univ.2) *Yuito Oba1, Ken-ichi Saitow1,2 |
|---|
11:42-12:00
| 4A10 | Record-Breaking Far-Red Silicon Quantum Dots LEDs Enabled by Solvent Engineering (Grad. Sch. Adv. Sci. Eng., Hiroshima Univ.1,N-BARD, Hiroshima Univ.2) *Li Wang1, Ken-ichi Saitow1,2 |
|---|
Room B [Surface]
09:00-09:18
| 4B01 | Ultrafast control of surface phonon polaritons in heterostructures of atomic layer materials. (Graduate School of Engineering, Osaka Metropolitan Univ.1,NIMS MANA2,IMS3) *Kazuki Kamada1, Masahiro Shibuta1, Daichi Kozawa2, Ryo Kitaura2, Jun Nishida3, Takashi Kumagai3 |
|---|
09:18-09:36
| 4B02 | Plexciton Formation Between In Nanoparticle and Molecules (Graduate School of Science, Kyoto Univ.1,Faculty of Liberal Arts, The Open University of Japan2) *Naoki Nagatsuka1, Kosuke Kawai1, Takanori Koitaya1, Hiroshi Okuyama1, Kazuya Watanabe1, Tomokazu Yasuike2 |
|---|
09:36-09:54
| 4B03 | Acceleration of Hydrogen Evolution Reaction of Ag Nanostructure (Department of Chemistry, Faculty of Science, Hokkaido University1,JST-PRESTO2,Graduate School of Chemical Sciences and Engineering, Hokkaido University3) *Tomohiro Fukushima1,2, Daiki Sato3, Takahiro Hayashi3, Masaki Itatani1, Kei Murakoshi1 |
|---|
09:54-10:12
| 4B04 | Reaction Kinetics on the CVD Growth from Methane to Nanoporous Graphene on Oxides Nanoparticles (Dept. Chem. Sci. Eng., SciTokyo1,Sch. Computing, SciTokyo2,RAP, RIKEN3) *Masanori Yamamoto1, Peien Chen2, Minori Saito1, Yuhei Kojima1, Dogen Cho1, Kaoru Yamazaki3, Ichiro Yamanaka1 |
|---|
10:12-10:30
| 4B05 | Surface enhanced infrared spectroscopy at 3D nanocomposite electrocatalysts in mesopores (Graduate School of Environmental Science, Hokkaido Univ.1,Faculty of Environmental Earth Science, Hokkaido University.2) Yuta Kato1, Masaru Kato2, *Ichizo Yagi2 |
|---|
10:48-11:06
| 4B07 | Low-frequency SERS observation of hydrogen-bonded water under hydrogen evolution in alkaline media (Nagoya Inst. Tech.) Naoki Kuroda, Kenta Motobayashi, *Katsuyoshi Ikeda |
|---|
11:06-11:24
| 4B08 | On the origin of surface propensity of specific ions: A study using spray ionization mass spectrometry (Graduate School of Science and Technology, Tsukuba Univ.1,Institute of Pure and Applied Science Univercity of Tsukuba2) *Kento Kosugi1, Naoki Numadate2, Shinichi Enami2 |
|---|
11:24-11:42
| 4B09 | Solid-state 2H-NMR analysis of the dynamics of hierarchical water clusters confined to molecular nanopores (Graduate School of Science, Tokyo Univ. of Sci.1,Graduate School of Natural Science and Technology, Kanazawa Univ.2) *Tomoya Namiki1, Yuta Numagami1, Fumiya Kobayashi1, Takuya Kurihara2, Motohiro Mizuno2, Makoto Tadokoro1 |
|---|
11:42-12:00
| 4B10 | Three-step structural transformation of water (H2O) ice formed by vapor-deposition at 120 K (Graduate School of Arts and Sciences, The Univ. of Tokyo) *Reo Sato, Kentaro Noguchi, Hiroyuki Koshida, Atsuki Ishibashi, Tetsuya Hama |
|---|
Room C [Solid phase]
09:00-09:18
| 4C01 | Crystal structures and air-stable n-type semiconductor properties of quinoidal propylenedioxythiophene dimers (The Institute for Solid State Physics, The Univ. of Tokyo1,National Institute of Advanced Industrial Science and Technology2) *Hiroshi Nishimoto1, Tomoko Fujino1, Toshiki Higashino2, Hatsumi Mori1 |
|---|
09:18-09:36
| 4C02 | Design and evaluation of FET-based non-volatile memory incorporating the Preyssler-type polyoxometalate thin film (Graduate School of Advanced Science and Engineering, Hiroshima Univ.1,Material Gate Inc.2,NIT, Ube College3,CResCent, Hiroshima Univ.4,PRESTO, JST5) *Masaki Arima1, Kazushi Takeda1, Rikuto Tamatani1, Yuki Nakano2, Chisato Kato1, Jun Manabe1, Masarumasaru Fujibayashi3, Takayoshi Nakamura1, Sadafumi Nishihara1,4,5 |
|---|
09:36-09:54
| 4C03 | Molecular orientation control of the acceptor layer in organic photovoltaics and its effect on charge generation efficiency (RIKEN CEMS) *Takaho Yokoyama, Keisuke Tajima |
|---|
09:54-10:12
| 4C04 | Synthesis of recyclable semiconductors and transistor characteristics (Department of Material Science and Engineering, Institute of Science Tokyo1,Department of Chemistry2) *Minoru Ashizawa1, Naoya Nozaki1, Azalea Uva2, Hidetoshi Matsumoto1, Helen Tran2 |
|---|
10:12-10:30
| 4C05 | A plot of quadrupole moments in organic semiconductors as a phase diagram of the crystal structures (Institute of Science Tokyo) *Takehiko Mori |
|---|
10:48-11:06
| 4C07 | Polar functionality based on long-range ion displacement in a non-polar crystal (Kyushu Univ.) *Ryo Ohtani |
|---|
11:06-11:24
| 4C08 | Structures and physical properties of molecular conductors based on Chp-TTP donors with selenium atoms: Emergence of a new organic superconductor (Graduate School of Science and Engineering, Ehime Univ.1,Research Unit for Materials Development for Efficient Utilization and Storage of Energy, Ehime Univ.2) *Yuina Watanabe1, Masahiro Fujisaki1,2, Takashi Shirahata1,2, Yohji Misaki1,2 |
|---|
11:24-11:42
| 4C09 | Structures and properties of BEDT-TTF salts with organic disulfonate (Graduate School of Science, The University of Osaka) *Hiroki Akutsu, Shun Ishibashi, Yasuhiro Nakazawa |
|---|
11:42-12:00
| 4C10 | Circular photogalvanic effect induced by bulk-polarity in two-dimensional organic-inorganic hybrid perovskite lead iodides (Graduate School of Science, Science Tokyo) *Ichi Naruse, Po-jung Huang, Kouji Taniguchi |
|---|
Room D [Biomolecules/Liquid phase]
09:00-09:18
| 4D01 | Nanosecond pulsed electric field effects on cancer and normal cells: possible key mechanism in cell-competition and photodynamic action? (Department of Applied Chemistry, NYCU1,CEFMS, NYCU2) *Nobuhiro Ohta1,2, Kamlesh Awasthi1,2, Hsin-yun Hsu1,2 |
|---|
09:18-09:36
| 4D02 | Highly Efficient Energy Transfer Processes in Chromatically Acclimating Photosynthetic Antenna Phycobilisomes (Faculty of Science, Kumamoto Univ.1,Graduate School of Engineering, Toyohashi Univ. of Tehchnology2,IINa, Kumamoto Univ.3) Naoki Suenaga1, Mari Nakagawa2, Mutsumi Kubushiro2, Yuu Hirose2, *Daisuke Kosumi3 |
|---|
09:36-09:54
| 4D03 | Photocycle-Induced Structural Changes of Heliorhodopsin with Locked Isomerization at the 13th Position of the retinal chromophore (Department of Life Science and Applied Chemistry, Nagoya Institute of Technology1,Department of Bioscience and Engineering, College of Systems Engineering and Science, Shibaura Institute of Technology2,Optobio Technology Research center, Nagoya Institute of Technology3) *Toshiki Nakamura1, Jiatong Lu2, Hideki Kandori1,3, Yoshitomo Suhara2, Yuji Furutani1,3 |
|---|
09:54-10:12
| 4D04 | Identification of amino acids responsible for differences in dimerization between green fluorescent protein eGFP and yellow fluorescent protein eYFP (Graduate School of Science, Toho Univ.) *Yuna Kinoshita, Haruko Hosoi |
|---|
10:48-11:24
| 4D07 | [Invited Talk] Molecular structural dynamics probed by pulsed X-rays (High Energy Accelerator Research Organization) *Shin-ichi Adachi |
|---|
11:24-11:42
| 4D09 | Formation of twisted intermediate during electronic relaxation of pyrimidine nucleobases (Graduate School of Science, Kyoto Univ.) *Yuki Obara, Srijon Ghosh, Alexander Humeniuk, Shota Kamibashira, Shunsuke Adachi, Toshinori Suzuki |
|---|
11:42-12:00
| 4D10 | Dynamic Slowdown and Spatial Correlations in Condensed Phase Systems: Insights from Dynamic Disorder (Institute for Molecular Science, Okazaki, Aichi) *Shubham Kumar, Shinji Saito |
|---|
Room E [Gas phase/Theory]
09:00-09:18
| 4E01 | Vibronic transitions involving non-totally symmetric modes in the Franck–Condon process of C6− and quadratic vibronic coupling density analysis (FIFC, Kyoto Univ.1,Graduate School of Engineering, Kyoto Univ.2) *Tetsuri Takami1,2, Naoki Haruta1,2, Tatsuhisa Kato1, Tohru Sato1,2 |
|---|
09:18-09:36
| 4E02 | Nuclear quantum effects in HCl/DCl dissociation and H⁺/ D⁺ transfer on the ice cluster (Grad. Sch. Sci., Saitama. Univ.1,Grad. Sch. Urb. Env. Sci., Tokyo Metro. Univ.2) Tatsuhiro Murakami2, *Hinami Ueno1, Yuya Kikuma1, Toshiyuki Takayanagi1 |
|---|
09:36-09:54
| 4E03 | Development of a high-temperature temperature-programmed desorption apparatus and its application to sublimation of cosmic dust (Graduate School of Arts and Sciences, Univ. of Tokyo) *Shiori Inada, Atsuki Ishibashi, Tetsuya Hama |
|---|
9:54-10:30
| 4E04 | [Invited Talk] Probing isotopic ratios in Space: windows into the chemical evolution of the interstellar medium (RIKEN Pioneering Research Institute) *Nami Sakai |
|---|
10:48-11:06
| 4E07 | CrypToth: A Method for Discovering Cryptic Sites in Proteins (CMB AIST1,IRC-SCT AIST2) *Jun Koseki1, Chie Motono1,2, Kenichiro Imai1,2 |
|---|
11:06-11:24
| 4E08 | Development of a free energy calculation method of umbrella sampling by using a multistate Bennett acceptance ratio and fittings of multi-dimensional normal distributions (Graduate School of Science, Osaka Metropolitan Univ.1,RIMED, Osaka Metropolitan Univ.2) *Yuki Mitsuta1,2, Toshio Asada1,2 |
|---|
11:24-11:42
| 4E09 | Theoretical Study on Solvent Effect of vibration based on FMO/MM (Fukui Institute for Fundamental Chemistry1,AIST2) *Hiroya Nakata1, Domitri Fedorov2 |
|---|
11:42-12:00
| 4E10 | An Accurate computational method for calculating configurational entropy based on solvation free energy calculation (OU Grad. Sch. Eng. Sci.) *Ryoma Kaji, Hervoe-hansen Stefan, Kento Kasahara, Nobuyuki Matubayasi |
|---|
Friday Afternoon Sessions(September 12, starting at 15:15)
Room B [Surface]
15:15-15:33
| 4B11 | Formation and Structural Control of Cu-Based Metal–Organic Framework Thin Films via Physical Vapor Deposition and Solvent Vapor Annealing (Graduate School of Science, The Univ. Tokyo1,Science Tokyo2,IMS3) *Ryo Nakayama1, Seonungmin Chon2, Shunta Iwamoto2, Shigeru Kobayashi1, Ryota Shimizu1,3, Taro Hitosugi1,2 |
|---|
15:33-15:51
| 4B12 | Structure and catalytic performances of platinum-ruthenium phosphide (Graduate School of Science, Nagoya Univ.1,RCMS, Nagoya Univ.2,SRIS, Tohoku Univ.3,IMRAM, Tohoku Univ.4) *Chihiro Yoshikawa1, Mai Nakanishi1, Takumi Moriyama1, Satoshi Muratsugu1, Kakeru Ninomiya3, Maiko Nishibori3,4, Mizuki Tada1,2 |
|---|
15:51-16:09
| 4B13 | Influence of the crystal and electronic structure of delafossite-type Cu oxides CuMO2 (M=Al, Co, Fe, and Ga) on the catalytic properties in electrochemical CO2 reduction (Dep. Chem., Grad. Sch. of Sci., Kyushu Univ.1,IMCE, Kyushu Univ.2,K-NETs, Kyushu Univ.3,Grad. Sch. of Sci., Osaka Metropolitan Univ.4,IREC, Osaka Metropolitan Univ.5,Grad. Sch. of Adv. Sci. and Eng., Hiroshima Univ.6,WPI-AIMR, Tohoku Univ.7,I2CNER, Kyushu Univ.8) *Takahiro Matsuu1, Akihiko Anzai2, David Rivera4,5, Masaki Donoshita1,2, Hirokazu Kobayashi1,3, Takayoshi Ishimoto6, Miho Yamauchi1,2,7,8 |
|---|
Room D [Liquid phase]
15:15-15:33
| 4D11 | X-ray absorption spectroscopy measurements and simulations for solutions of organic compounds (Graduate School of Frontier Sciences, UTokyo1,Institute for Molecular Science, NINS2) *Haoran Xu1, Masanari Nagasaka2, Takehiko Sasaki1 |
|---|
15:33-15:51
| 4D12 | Modeling acid dissociation in aqueous solution using long-range-corrected deep potential molecular dynamics (Graduate School of Engineering, The University of Osaka1,SCREEN Holdings Co., Ltd.2,Department of Physics, Universitas Airlangga3,Research Center for Quantum Engineering Design, Universitas Airlangga4) *Rizka Fadilla1, Toshihiro Kume1,2, Harry Halim1, Febdian Rusydi3,4, Yoshitada Morikawa1 |
|---|
15:51-16:09
| 4D13 | Analysis of the Decrease in Diffusion Coefficient Due to Exposure of OH Groups on a Fullerenol Surface Using Molecular Dynamics (Department of Chemistry, Kyushu University1,Department of Physics and Information Technology, Kyushu Institute of Technology2,Department of Chemistry, Kyoto University3) *Tomoya Iwashita1, Yuki Uematsu2, Masahide Terazima3, Ryo Akiyama1 |
|---|
16:09-16:27
| 4D14 | Quantitative calculations of vibrational OH-stretching and thin-film spectra of H2O through extended quantum/classical approach (Graduate School of Arts and Sciences, UTokyo1,Graduate School of Science and Engineering, Saitama Univ.2) *Ianfitch Mochida1, Tetsuyuki Takayama2, Shoichi Yamaguchi2, Tetsuya Hama1 |
|---|
Room E [Theory]
15:15-15:51
| 4E11 | [Invited Talk] Understanding and Controlling Biological Functions through Integrated Computational Chemistry Methods (CCS, Univ. Tsukuba) *Yasuteru Shigeta |
|---|
15:51-16:09
| 4E13 | Taming multi-domain, -fidelity data: towards foundation models for atomistic scale simulations (QIQB, Osaka Univ) *Tomoya Shiota, Kenji Ishihara, Tuan minh Do, Toshio Mori, Wataru Mizukami |
|---|
16:09-16:27
| 4E14 | Decoding and engineering the catalytic activity of inhomogeneous Ru nanoparticles (Graduate School of Advanced Science and Engineering, Hiroshima University1,Department of Chemistry, Graduate School of Science, Osaka Metropolitan University2,International Research and Education Center, Graduate School of Science, Osaka Metropolitan University3) *David samuel Rivera rocabado1,2,3, Mika Aizawa1, Takayoshi Ishimoto1 |
|---|