Saturday, September 19 (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.
Venue A Morning
Venue B Morning
Venue C Morning
Venue D Morning
Venue E Morning
Venue A Afternoon Venue B Afternoon Venue C Afternoon Venue D Afternoon Venue E Afternoon
Venue A Afternoon Venue B Afternoon Venue C Afternoon Venue D Afternoon Venue E Afternoon
Saturday Morning Sessions(September 19, starting at 9:30)
| 9:30-9:48 | 1A01 | One-dimensionally conjugated cyanine dyes studied by cryogenic gas-phase spectroscopy (Graduate School of Advanced Science and Engineering, Hiroshima Univ.) *Satoru Muramatsu, Takayuki Tokizane, Yoshiya Inokuchi |
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| 9:48-10:06 | 1A02 | Cleavage of chemical bonds by molecular vibrational excitation with infrared chirped-pulse lasers (TCRDL) *Takahiro Horiba, Soichi Shirai, Hirotoshi Hirai |
| 10:06-10:24 | 1A03 | [Withdraw] |
| 10:24-10:42 | 1A04 | Exploration of energy transfer pathways for syn-anti isomers using a full-degrees-of-freedom analysis approach. (Hiroshima Univ.) *Yugo Unemi, Tatsuya Yamaguchi, Kento Inoue, Katsuyoshi Yamasaki, Hiroshi Kohguchi |
| 11:00-11:18 | 1A05 | Symmetry breaking in electron-induced dissociative ionization of symmetric molecules (IMRAM, Tohoku Univ.) *Noboru Watanabe, Masahiko Takahashi |
| 11:18-11:36 | 1A06 | Space-time exchanged symplectic integrator approach to temporal-mode selective optical parametric frequency conversion (CST, Nihon Univ.) *Kenya Nomura, Tokuei Sako |
| 11:36-11:54 | 1A07 | Rotational spectroscopy of propylene dimers by time-resolved Coulomb explosion imaging (Department of Chemistry, Tokyo Tech1,Department of Chemistry, School of Science, Kitasato Univ2) *Yuya Tobata1, Kenta Mizuse2,1, Yasuhiro Ohshima1 |
| 11:54-12:12 | 1A08 | Development of quantitative atomic momentum spectroscopy and its application to molecular science (IMRAM, Tohoku University) *Yuuki Onitsuka, Yuichi Tachibana, Masahiko Takahashi |
Venue B [Clusters/particles/nanostructures]
| 9:30-9:48 | 1B01 | Heat induced changes of adsorption forms of NO on rhodium anion cluster studied by photoelectron spectroscopy (Graduate School of Arts and Science, The University of Tokyo) *Keitaro Tatsukawa, Masato Yamaguchi, Ken Miyajima, Fumitaka Mafune |
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| 9:48-10:06 | 1B02 | Electron affinities of ligand-protected gold/silver superatoms revisited: suppression of multiphoton photoelectron detachment (Graduate School of Science, The University of Tokyo1,Graduate School of Science, Tokyo Insititute of Technology2,Laboratory for Chemistry and Life Science, Tokyo Insititute of Technology3,WRHI, Tokyo Institute of Technology4) *Shun Ito1, Yuriko Tasaka1, Katsunosuke Nakamura1, Yuki Fujiwara1, Keisuke Hirata2,3,4, Kiichirou Koyasu1, Tatsuya Tsukuda1 |
| 10:06-10:24 | 1B03 | Photoelectron spectroscopy of alkanethiolate-protected superatomic cluster anions: ligand structure effects on electron injection barrier and charging energy (Graduate School of Science, The University of Tokyo1,Elements Strategy Initiative for Catalysts and Batteries, Kyoto University2) Yuriko Tasaka1, Shun Ito1, Megumi Suyama1, *Kiichirou Koyasu1,2, Tatsuya Tsukuda1,2 |
| 10:24-10:42 | 1B04 | Optical absorption processes in size-selected silver cluster anions, AgN- (N = 3–11): Competition between electron detachment and dissociation (Graduate School of Science, Kyushu Univ.) *Shun Kawamura, Satoshi Kono, Masato Yamaguchi, Masashi Arakawa, Takuya Horio, Akira Terasaki |
| 11:00-11:18 | 1B05 | Collision-induced dissociation of phosphine-protected oblate gold cluster Au9(PPh3)83+ (Graduate School of Advanced Science and Engineering, Hiroshima Univ.1,Graduate School of Science, The Univ. of Tokyo2,ESICB, Kyoto University3) *Yuki Nakahigashi1, Satoru Muramatsu1, Tsubasa Omoda2, Shinjiro Takano2, Takuya Tsukuda2,3, Yoshiya Inokuchi1 |
| 11:18-11:36 | 1B06 | Stable compositions of gas-phase silicon oxide clusters probed by thermal desorption spectrometry and their reactions with hydrogen (Grad. Sch. of Arts & Sci., The Univ. of Tokyo) *Toshiaki Nagata, Ken Miyajima, Fumitaka Mafune |
| 11:36-12:12 | 1B07 | [Young Scientist Award Talk] Targeted Synthesis of Ligand-Protected Gold Clusters and Exploration of Their Design Principles (Graduate School of Science, The Univ. of Tokyo) *Shinjiro Takano |
| 9:30-9:48 | 1C01 | Molecular-selective diffusion dynamics measurement: Dynamic Raman scattering (NIMS1,Dept. of Chemistry, Kyushu Univ.2) *Takashi Hiroi1, Sadaki Samitsu1, Kunie Ishioka1, Hideaki Kano2 |
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| 9:48-10:06 | 1C02 | Low-Frequency Spectra of Phosphonium-Based Ionic Liquids with Pentyl, Ethoxyethyl, and 2-(Ethylthio)ethyl Groups: Raman Scattering and THz Wave Absorption (Department of Chemistry, Chiba Univ.1,Department of Chemistry, Kobe Univ.2,Department of Theoretical and Computational Molecular Science, Institute for Molecular Science3) *Masatoshi Ando1, Kaoru Ohta2, Tateki Ishida3, Keisuke Tominaga2, Hideaki Shirota1 |
| 10:06-10:24 | 1C03 | Application of hyper-Raman spectroscopy to study the concentrated aqueous acids (Graduate School of Arts and Sciences, The University of Tokyo) *Kazuki Inoue, Masanari Okuno |
| 10:24-10:42 | 1C04 | Highly sensitive time-domain Raman spectroscopy by fluorescence encoding (Graduate school of science, The University of Tokyo1,University of California, Los Angeles2,Wuhan University3) *Tetsu Tamura1, Phillip Mccann1, Kotaro Hiramatsu1, Keisuke Goda1,2,3 |
| 11:00-11:18 | 1C05 | Hydrogen Bond Network in Aqueous Dimethyl Sulfoxide Solutions Observed by Soft X-ray Absorption Spectroscopy (IMS1,SOKENDAI2) *Masanari Nagasaka1,2 |
| 11:18-11:36 | 1C06 | Spectroscopic study of halogen bonding in solution (Graduate School of Engineering, Osaka Univ.1,ICS-OTRI, Osaka Univ.2) *Yasutaka Yoshida1, Yuta Uetake1,2, Ramadhani Ihsan1, Hidehiro Sakurai1,2 |
| 11:36-11:54 | 1C07 | Frequency fluctuation of [RuCl5(NO)]2− in water studied by two-dimensional infrared spectroscopy and molecular dynamics simulation (Graduate School of Science, Kobe Univ.1,Molecular Photoscience Research Center, Kobe Univ.2) *Yuki Fujii1, Kyoko Aikawa1, Jumpei Tayama2, Motohiro Banno2, Kaoru Ohta2, Keisuke Tominaga1,2 |
| 11:54-12:12 | 1C08 | Polaritonic control of the ionic conductivity of concentrated electrolyte (Department of Chemistry, Faculty of Science, Hokkaido University1,Department of Chemistry, Faculty of Science, Hokkaido University2) *Tomohiro Fukushima1, Keiji Moriya2, Soushi Yoshimitsu2, Kei Murakoshi1 |
| 9:30-9:48 | 1D01 | Photo-excited carrier dynamics of zinc phthalocyanine thin films grown on HOPG substrates (SL Center, Saga Univ.) *Isamu Yamamoto, Sho Nagatomo, Junpei Azuma, Masaki Imamura, Kazutoshi Takahashi |
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| 9:48-10:06 | 1D02 | Electrochemical ATR UV-Visible spectroscopy applied for ionic liquid/organic semiconductor interfaces (Rikkyo Univeristy1,Osaka University2,The University of Tokyo3) *Ichiro Tanabe1, Iroha Imoto2, Daijiro Okaue2, Masaya Imai2, Shohei Kumagai3, Tatsuyuki Makita3, Masato Mitani3, Toshihiro Okamoto3, Jun-ichi Takeya3, Ken-ichi Fukui2 |
| 10:06-10:24 | 1D03 | Non-contact evaluation of molecular conductivity of organic monolayers utilizing core-excitation dynamics (Graduate School of Adv. Sci. and Eng., Hiroshima Univ.1,HiSOR, Hiroshima Univ.2) *Shin-ichi Wada1,2, Ryosuke Koga1, Mai Ogawa1, Shogo Tendo1, Akinobu Niozu1 |
| 10:24-10:42 | 1D04 | Tip-Enhanced Raman Thermometry of Single-Molecule Junctions (Institute for Molecular Science1,Fritz Haber Institute2) *Takashi Kumagai1,2, Borja Cirera2 |
| 11:00-11:36 | 1D05 | [Invited Talk] Wearable SERS for wearable molecular science (Graduate School of Science, University of Tokyo1,Wuhan University2,UCLA3,Shenzhen University4,LucasLand5) *Keisuke Goda1,3,2,5, Limei Liu4, Pablo Pancorbo1, Tinghui Xiao1, Yasutaka Kitahama1,5 |
| 11:36-11:54 | 1D07 | Origin of Surface Charging by Sum Frequency Spectroscopy and Non-Contact Visualization (Graduate School of Science and Engineering, Chiba University1,Molecular Chirality Research Center, Chiba University2,Soft Molecular Activation Research Center, Chiba University3) *Takayuki Miyamae1,2,3, Yuuka Isaka1 |
| 11:54-12:12 | 1D08 | Monatomic iodine dielectric layer for multimodal optical spectroscopy of dye molecules on metal surfaces (RIKEN1,JST PRESTO2) *Yasuyuki Yokota1,2, Raymond Wong1, Misun Hong1, Norihiko Hayazawa1, Yousoo Kim1 |
| 9:30-9:48 | 1E01 | Theoretical study of dynamic Stark induced degenerate state by two non-resonant shifting up lasers beyond the frozen nuclei approximation (Science and Technology Advanced Institute (STAI), Van Lang University, Vietnam1,Department of Physics, Ho Chi Minh City University of Education, Vietnam2,Department of Chemistry, Graduate School of Science, Tohoku University3) *Hirobumi Mineo1, Ngoc-loan Phan2, Quang huy Ho2, Yuichi Fujimura3 |
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| 9:48-10:06 | 1E02 | Coupled electronic and protonic motion in H2O in intense laser fields by extended multi-configuration time-dependent Hartree-Fock method (School of Science, The University of Tokyo) *Lidong Wang, Ryuto Kimura, Tsuyoshi Kato, Kaoru Yamanouchi |
| 10:06-10:24 | 1E03 | Electron flux and nonadiabaticity (Fukui Institute for Fundamental Chemistry) *Kota Hanasaki, Kazuo Takatsuka |
| 10:24-10:42 | 1E04 | Non-adiabatic calculation of dissociation X-ray spectrum of muonic molecular ions (IEHE, Tohoku Univ.1,Department of Chemistry, Tohoku Univ.2) *Takuma Yamashita1,2, Kazuhiro Yasuda2, Kenichi Okutsu2, Yasushi Kino2 |
| 11:00-11:18 | 1E05 | A quantum Monte Carlo study of positron binding in molecular dianion system (RIKEN, Nishina Center1,Graduate School of Naobioscience, Yokohama City Univ.2) Shumpei Ito2, *Daisuke Yoshida1,2, Yukiumi Kita2, Tomomi Shimazaki2, Masanori Tachikawa2 |
| 11:18-11:36 | 1E06 | A path integral molecular dynamics study of the muoniated xanthenethione (Graduate School of Nanobioscience, Yokohama City University1,Department of Materials Science and Engineering, Tokyo Institute of Technology2) *Kazuaki Kuwahata1, Shigekazu Ito2, Masanori Tachikawa1 |
| 11:36-11:54 | 1E07 | Evaluation of vibrational energies and wave functions of CO2 on a quantum computer (School of Science, The University of Tokyo1,DIC Corporation2) *Erik Lötstedt1, Kaoru Yamanouchi1, Yutaka Tachikawa2 |
| 11:54-12:12 | 1E08 | Reaction dynamics analysis of pericyclic reaction with trifurcation pathways based on reduced-dimensionality potential energy surface (Fac. Sci., Hokkaido Univ.1,L-Station, Hokkaido Univ.2,Sch. Sci., Hokkaido Univ.3,Grad. Sch. Chem. Sci. Eng., Hokkaido Univ.4,WPI-ICReDD, Hokkaido Univ.5) *Takuro Tsutsumi1,2, Akifumi Fujita3, Kenichiro Iwata4, Yuriko Ono5, Tetsuya Taketsugu1,5 |
Saturday Afternoon Sessions(September 19, starting at 15:00)
| 15:00-15:18 | 1A09 | Dissociative ionization of aligned O2 in an intense femtosecond laser field (Graduate School of Arts and Sciences, The Univ. of Tokyo1,Komaba Institute for Science, The Univ. of Tokyo2) *Shinichi Fukahori1,2, Ayumi Kubo1, Hirokazu Hasegawa1,2 |
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| 15:18-15:36 | 1A10 | Orientation-selective molecular ionization of hydrofluorocarbon using intense phase-controlled laser fields 2 (AIST1,Graduate School of Science,Tohoku University2) *Hideki Ohmura1, Naoaki Saito1, Kenichi Okutsu2 |
| 15:36-15:54 | 1A11 | Dissociative tunneling ionization of CF4 in phase-locked ω-2ω intense laser fields (Grad. Sch. Science, Nagoya U1,Sch. Chem., U Edinburgh2,Inst. Adv. Sci. U Electro-Commun.3,Dept. Phys. Astronomy, Aarhus U4,Dept. Chem., Aarhus U5,Moscow Inst. Phys. Tech.6,RCMS, Nagoya U7) *Hiroka Hasegawa1, Tiffany Walmsley2, Akitaka Matsuda1, Toru Morishita3, Bojor Madsen4, Frank Jensen5, Oleg Tolstikhin6, Akiyoshi Hishikawa1,7 |
| 15:54-16:12 | 1A12 | Development of momentum imaging method using event-based image sensor (RIKEN) *Tomoya Okino, Katsumi Midorikawa |
| 16:30-17:06 | 1A13 | [Invited Talk] Spectroscopic study on functional organic molecules (Hiroshima University) *Yoshiya Inokuchi |
| 17:06-17:24 | 1A15 | Ion Selectivity of Beauvericin and its Mechanism Studied by Mass-coupled Cold Ion Trap Infrared Spectroscopy and Computational Study (Laboratory for Chemistry and Life Science, Institute of Innovative Research, Tokyo Institute of Technology. 4259 Nagatsuta-cho, Midori-ku, Yokohama, 226-8503, Japan1,School of Life Science and Technology, Tokyo Institute of Technology. 4259 Nagatsuta-cho, Midori-ku, Yokohama, Kanagawa, 226-8503, Japan2,Department of Chemistry, School of Science, Tokyo Institute of Technology, 2-12-1 Ookayama, Meguro-ku, Tokyo 152-8550, Japan3,International Research Frontiers Initiative (IRFI), Institute of Innovative Research, Tokyo Institute of Technology, 4259, Nagatsuta-cho, Midori-ku, Yokohama, 226-8503, Japan4,Department of Chemistry, University of Illinois at Urbana-Champaign, Urbana, IL 61801, USA5) *Kien Vo1,2, Keisuke Hirata1,3,4, James Lisy4,5, Shun-ichi Ishiuchi1,3,4, Masaaki Fujii1,2,4 |
| 17:24-17:42 | 1A16 | Role of the 3s and 3p Rydberg states in the ultraviolet photodissociation of dimethylamine (Graduate School of Advanced Science and Engineering, Hiroshima Univ.) *Peerapat Wangchingchai, Katsuyoshi Yamasaki, Hiroshi Kohguchi |
Venue B [Clusters/particles/nanostructures]
| 15:00-15:18 | 1B09 | Hydrogen storage capacity of Nb doped Al clusters investigated by thermal desorption spectroscopy in the gas phase (Graduate School of Arts and Sciences, The Univ. of Tokyo) *Yufei Zhang, Toshiaki Nagata, Satoshi Kudoh, Ken Miyajima, Fumitaka Mafuné |
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| 15:18-15:36 | 1B10 | Optical response of C60/Ag co-adsorbed on Graphene (Department of Chemistry, Graduate School of Science, Kyoto University1,Faculty of Liberal Arts, The Open University of Japan2) *Tatsuya Yoshida1, Kazuya Watanabe1, Tomokazu Yasuike2 |
| 15:36-16:12 | 1B11 | [Invited Talk] Molecular structures and energy-related functions based on hydrogen: viewpoints from HYDROGENOMICS (WPI-AIMR, Tohoku University1,Institute for Materials Research, Tohoku University2,IMSS-KEK3) *Shin-ichi Orimo1,2,3 |
| 16:30-16:48 | 1B13 | Hydrogen evolution reaction by sub-nano Pt clusters: size-dependent electrocatalytic activity and mechanistic insights (University of Utah1,UCLA2) *Tsugunosuke Masubuchi1, Simran Kumari2, Zisheng Zhang2, Philippe Sautet2, Anastassia n. Alexandrova2, Henry s. White1, Scott l. Anderson1 |
| 16:48-17:06 | 1B14 | Highly-efficient conversion reaction of greenhouse gasses catalyzed by nickel atomic clusters (Lab. Chem. Life Sci., Tokyo Tech1,JST-PRESTO2,JST-ERATO3,Integrated Center for Science and Humanities, Fukushima Medical Univ4) *Takamasa Tsukamoto1,2,3, Tatsuya Moriai1, Makoto Tanabe4,3, Tetsuya Kambe1,3, Kimihisa Yamamoto1,3 |
| 17:06-17:24 | 1B15 | Exploring Metal Cluster Catalysts Using Swarm Intelligence (Faculty of Engineering Sciences, Kyushu Univ.1,IMCE, Kyushu Univ.2) *Yuta Tsuji1, Mikiya Hori2, Kazunari Yoshizawa2 |
| 17:24-17:42 | 1B16 | Highly-durable low-temperature catalysis driven by uni-sized Pt clusters bound to SiC substrate (Cluster Res. Lab., Toyota Tech. Inst.1,East Tokyo Lab., Genesis Res. Inst., Inc.2) *Hisato Yasumatsu1, Nobuyuki Fukui2 |
| 15:00-15:18 | 1C09 | Molecular level origin of unidirectional charge separation pathway in photosynthetic reaction centers (Graduate School of Engineering, The University of Tokyo) *Hiroyuki Tamura, Keisuke Saito, Hiroshi Ishikita |
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| 15:18-15:36 | 1C10 | Electronic structure of iron-sulfur clusters and their influence from surrounding amino acids in high-potential iron-sulfur proteins. (Graduate School of Science and Technology, Univ. of Tsukuba1,Center for Computational Sciences, Univ. of Tsukuba2) *Ayaka Sato1, Yuta Hori2, Yasuteru Shigeta2 |
| 15:36-15:54 | 1C11 | Spectral Tuning Mechanism of Photosynthetic Light-Harvesting Complexes (Graduate School of Science, Nagoya Univ.1,Institute of Transformative Bio-Molecules (ITbM), Nagoya Univ.2) *Takuya Seki1, Takumi Minoda1, Kazuhiro Fujimoto1,2, Takeshi Yanai1,2 |
| 15:54-16:12 | 1C12 | Exploring the mutagenesis mechanism in DNA damaged by O6-methylguanine via through-space/bond orbital interaction analysis (Interdisciplinary Graduate School of Engineering Sciences, Kyushu University1,Department of Material Sciences, Faculty of Engineering Sciences, Kyushu University2) *Mariia Ivonina1, Yuuichi Orimoto2, Yuriko Aoki2 |
| 16:30-16:48 | 1C13 | Molecular dynamics analysis of the protein-ligand binding kinetics (大阪大院基礎工) *Kento Kasahara, Ren Masayama, Kazuya Okita, Nobuyuki Matubayasi |
| 16:48-17:06 | 1C14 | Extension of the SPICA coarse-grained force field to proteins and its application (Research Institute for Interdisciplinary Science, Okayama Univ.) *Yusuke Miyazaki, Wataru Shinoda |
| 17:06-17:24 | 1C15 | Aβ aggregation process studied by molecular simulation and experiments (IMS1,ExCELLS2,SOKENDAI3,Nagoya City Univ.4) *Satoru g. Itoh1,2,3, Maho Yagi-utsumi1,2,3,4, Koichi Kato1,2,3,4, Hisashi Okumura1,2,3 |
| 17:24-17:42 | 1C16 | Stark fluorescence spectroscopy of thioflavin-T: estimation of protein-induced electric fields on the surface of amyloid fibrils (Graduate School of Engineering, Muroran Institute of Technology) *Ahatashamul Islam, Yudai Kikuchi, Toshifumi Iimori |
| 15:00-15:18 | 1D09 | Alternately stacked charge-transfer complexes in a neutral–ionic boundary region: high conductivity and phase transition behavior (ISSP, The Univ. of Tokyo1,Dep. of Advanced Materials Science, The Univ. of Tokyo2,IMS3) *Tomoko Fujino1, Ryohei Kameyama1, Kota Onozuka1, Kazuki Matsuo1, Shun Dekura1, Tatsuya Miyamoto2, Zijing Guo2, Hiroshi Okamoto2, Toshikazu Nakamura3, Hatsumi Mori1 |
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| 15:18-15:36 | 1D10 | Generalized phase-diagram of 1D organic conductors (TMTTF)2X: structure and electronic phase (IMS1,Niigata Univ.2,RIKEN3,Dept. of Appl. Phys., Nagoya Univ.4) *Toshikazu Nakamura1, Ko Furukawa2, Shunsuke Kitou3, Hiroshi Sawa4 |
| 15:36-15:54 | 1D11 | 2D interactive spin ladder system, δ´-(BEDT-TTF)2ClC2H4SO3·H2O (Graduate School of Science, Osaka Univ.) *Hiroki Akutsu, Yasuhiro Nakazawa |
| 15:54-16:12 | 1D12 | Electrical and magnetic properties of neutral radical crystals composed of axially ligated metal tetrabenzoporphyrin (Graduate School of Science and Technology, Kumamoto Univ.1,Faculty of Advanced Science and Technology, Kumamoto Univ.2,Graduate School of Science, Osaka Univ.3) *Kosuke Mine1, Hiroshi Murakawa3, Noriaki Hanasaki3, Masaki Matsuda2 |
| 16:30-16:48 | 1D13 | Mixed sequence thiophen oligomer salt modeling doped PEDOT: synthesis and metallic behavior (The Institute for Solid State Physics, The University of Tokyo1,Institute for Molecular Science2,Department of Advanced Materials Science, The University of Tokyo3) *Kota Onozuka1, Tomoko Fujino1, Ryohei Kameyama1, Toshikazu Nakamura2, Shun Dekura1, Tatsuya Miyamoto3, Hiroshi Okamoto3, Kazuyoshi Yoshimi3, Hatsumi Mori1 |
| 16:48-17:06 | 1D14 | Influence of Modulation of Molecular Arrangement on Magnetic property in Novel Single-component Molecular Conductor with Weak Ferromagnetism (College of Science, Rikkyo University1,ISSP, The University of Tokyo2) *So Yokomori1,2, Shun Dekura2, Masatoshi Ito2, Tomoko Fujino2, Shusaku Imajo2, Nobuyuki Matsushita1, Hatsumi Mori2 |
| 17:06-17:24 | 1D15 | Organic transistors of charge-transfer complexes (Tokyo Institute of Technology, Department of Materials Science and Engineering) Baiyan Liu, Rao mallela Nikhil, Shuxiang Fan, Ruoxi Huang, Tadashi Kawamoto, *Takehiko Mori |
| 17:24-17:42 | 1D16 | An isotropic three-dimensional organic semiconductor TP-BT: synthesis and thin-film transistor properties (Graduate School of Engineering, University of Hyogo1,Graduate School of Science, University of Hyogo2,School of Science, University of Hyogo3) *Hiroshi Nishimoto1, Tomofumi Kadoya2, Rikyu Miyake3, Takeshi Oda2, Jun-ichi Nishida1, Kazuya Kubo2, Hiroyuki Tajima2, Takeshi Kawase1, Jun-ichi Yamada2 |
| 15:00-15:18 | 1E09 | Quantum chemical calculation of excited States using variational quantum deflation method and applications to photocatalyst modelling. (TCRDL) *Soichi Shirai, Takahiro Horiba, Hirotoshi Hirai |
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| 15:18-15:36 | 1E10 | Calculation of polarizability by analytical derivative of orbital-optimized variational quantum eigensolver (OO-VQE) (QunaSys1,JSR Corp.2,QIQB, Osaka Univ.3,JST-PRESTO4) *Yuya Nakagawa1, Jiabao Chen1, Shotaro Sudo2, Yu-ya Ohnishi2, Wataru Mizukami3,4 |
| 15:36-15:54 | 1E11 | Application of the hardware-efficient ansatz to realtime ab initio simulations (Univ. Tokyo1,IBM2) *Yuki Orimo1, Kenichi Ishikawa1, Yukio Kawashima2, Tanvi Gujarati2, Takeshi Sato1 |
| 15:54-16:12 | 1E12 | Artificial neural network encoding of molecular wave function as quantum algorithm (Department of Chemistry, Nagoya Univ.1,National Institute of Informatics2,Graduate School of Frontier Sciences, Tokyo Univ.3) *Masaya Hagai1, Mahito Sugiyama2, Koji Tsuda3, Takeshi Yanai1 |
| 16:30-16:48 | 1E13 | Multicenter molecular integrals over Slater-type-orbitals-Derivation of the expression for expanding two 1s-STOs with different centers as the function at any point. (no affiliation) *Kazuhiro Ishida |
| 16:48-17:06 | 1E14 | Modified Local Excitation Approximation for fast and accurate TDDFT calculations in photoactive center of macromolecules (Interdisciplinary Graduate School of Engineering Sciences, Kyushu University) *Denis Mashkovtsev, Yuuichi Orimoto, Yuriko Aoki |
| 17:06-17:24 | 1E15 | Analytic Derivatives of the CAPST2 and RASPT2 Method (Graduate School of Science, Kyoto Univ.1,Department of Chemistry, Uppsala Univ.2) *Yoshio Nishimoto1, Stefano Battaglia2, Roland Lindh2 |
| 17:24-17:42 | 1E16 | Development of the DMRG-DOCI-PT2 method (Graduate School of Science, Tokyo Metropolitan Univ.) *Yutaro Otani, Naoki Nakatani, Masahiko Hada |