第39回化学反応討論会

Program

Time Table [PDF]

PDF file of the Abstract Book can be downloaded here. [Abstract Book]

Special Lecture: (50 min, including discussion)
SL
"Effects of Nanosecond Pulsed Electric Field on Intracellular Dynamics and Function and Differences between Cancer and Normal Cells"
 OHTA, Nobuhiro (National Yang Ming Chiao Tung University)
 June 13, 16:40 - 17:30

Invited Lectures: (40 min, including discussion)
IL1
"Tracking non-equilibrium excited-state dynamics with ultrafast time-domain vibrational spectroscopy"
 KURAMOCHI, Hikaru (Institute for Molecular Science)
 June 12, 10:55 - 11:35
IL2
"Multiple-Layeared Axial Heterostructure Nanorods for Multicolor Polariton Nanolaser"
 SONG, Jae Kyu (Kyung Hee University)
 June 12, 13:45 - 14:25
IL3
"Molecular-level chemical theories for reactions and self-assembly"
 SATO, Hirofumi (Kyoto University)
 June 13, 10:50 - 11:30
IL4
"Linking Potential Energy Surface with Experimental Observables"
 KUO, Jer-Lai (Institute of Atomic and Molecular Sciences)
 June 13, 13:45 - 14:25
IL5
"Control of chemical reactions by strong coupling between plasmon nanocavities and molecules"
 YASUIKE, Tomokazu (The Open University of Japan)
 June 14, 9:45 - 10:25
IL6
"Spectroscopic Approach for Vibrational Polaritonic Systems"
 KATSUKI, Hiroyuki (Nara Institute of Science and Technology)
 June 14, 14:05 - 14:45

Oral Presentations: (June 12-14)
1A1 - 3A2 (15 min talk with 10 min discussion)

Poster Presentations:
1P01 - 1P18 (June 12, 15:05 - 16:35)
2P01 - 2P19 (June 13, 15:05 - 16:35)
3P01 - 3P14 (June 14, 10:40 - 12:10)



Day 1 (June 12)


9:45 - 9:50 Opening Remarks


9:50 - 10:40 Oral Presentations (Chair: )

1A1
Observation of a new type of bands in electron-atom Compton scattering spectra
ONITSUKA Yuuki; KANAYA Satoru; TAKAHASHI Masahiko
(IMRAM, Tohoku University)

1A2
All-optical field-free molecular orientation
MINEMOTO, Shinichirou; HARA, Naoki; SAKAI, Hirofumi
(The University of Tokyo)


10:40 - 10:55 Coffee/Tea Break


10:55 - 12:00 Oral Presentations (Chair: )

IL1
Tracking non-equilibrium excited-state dynamics with ultrafast time-domain vibrational spectroscopy
KURAMOCHI, Hikaru
(Institute for Molecular Science)

1A3
Ultrafast ring-opening of 1,3-cyclohexadiene: A theoretical study on the conrotatory and disrotatory pathways
SAITA, Kenichiro1; SEKIKAWA, Taro2; TAKETSUGU, Tetsuya1,3;
(1Faculty of Science, Hokkaido University; 2Faculty of Engineering, Hokkaido University; 3WPI-ICReDD, Hokkaido University)


12:00 - 13:45 Lunch Break


13:45 - 14:50 Oral Presentations (Chair: )

IL2
Multiple-Layered Axial Heterostructure Nanorods for Multicolor Polariton Nanolaser
SONG, Jae Kyu
(Kyung Hee University)

1A4
Vibrational Motions in Ultrafast Electronic Relaxation of Pyrazine
KARASHIMA, Shutaro; HUMENIUK, Alexander; SUZUKI, Toshinori
(Kyoto University)


14:50 - 15:05 Coffee/Tea Break


15:05 - 16:35 Poster Presentations


16:40 - 17:55 Oral Presentations (Chair: )

1A5
Ring-polymer MD simulation of dissociative photodetachment dynamics of CH3O-(H2O) + hν → CH3O + H2O + e- reaction
MURAKAMI, Tatsuhiro1,2; TAKAYANAGI, Toshiyuki1
(1Saitama University; 2Sophia University)

1A6
Experimental investigations on the fate of carbon atoms on interstellar icy grains
TSUGE, Masashi; WATANABE, Naoki
(Hokkaido University)

1A7
Formation of H3+ on stainless steel surface by irradiation of near-infrared femtosecond laser pulses
SHIROTA, Tatsuro1; Hoshina, Kennosuke1; YAMANOUCHI, Kaoru2
(1Niigata University of Pharmacy and Medical and Life Sciences; 2I-ALFA, The University of Tokyo)





Day 2 (June 13)


9:20 - 10:35 Oral Presentations (Chair: )

2A1
Simulation of rovibronic laser-driven dynamics of H2+ by a multiconfiguration method
LÖTSTEDT, Erik; KATO, Tsuyoshi; YAMANOUCHI, Kaoru
(The University of Tokyoy)

2A2
Angular dependence of ionization probability of N2 in an intense laser field
FUKAHORI, Shinichi1,2; HASEGAWA, Hirokazu1,2
(1Graduate School of Arts and Sciences, The Univ. of Tokyo; 2Komaba Institute for Science, The Univ. of Tokyo)

2A3
Asymmetric Coulomb explosion of methane in ω-2ω intense laser fields studied by coincidence momentum imaging
HASEGAWA, Hiroka1; MATSUDA, Akitaka1; MORISHITA, Toru2; MADSEN, Lars Bojer3; JENSEN, Frank3; TOLSTIKHIN, Oleg I.4; HISHIKAWA, Akiyoshi1
(1Nagoya University; 2University of Electro-Communications; 3Aarhus University; 4Moscow Institute of Physics and Technology)


10:35 - 10:50 Coffee/Tea Break


10:50 - 11:55 Oral Presentations (Chair: )

IL3
Molecular-level chemical theories for reactions and self-assembly
SATO, Hirofumi
(Kyoto University)

2A4
Nuclear quantum effects on phase transitions of high-pressure ice
KUWAHATA, Kazuaki1,2; TACHIKAWA, Masanori2
(1Tokyo Institute of Technology; 2Yokohama City University)


11:55 - 13:45 Lunch Break


14:00 - 14:50 Oral Presentations (Chair: )

IL4
Linking Potential Energy Surface with Experimental Observables
KUO, Jer-Lai
(Institute of Atomic and Molecular Sciences)

2A5
Experimental and theoretical vibrational spectroscopy of aqueous electrolyte solution
TAKAYAMA, Tetsuyuki; SHIOTA, Harutaka; OTOSU, Takuhiro; YAMAGUCHI, Shoichi
(Saitama University)


15:05 - 15:05 Coffee/Tea Break


15:05 - 16:35 Poster Presentations


16:40 - 17:30 Oral Presentations (Chair: )

SL
Effects of Nanosecond Pulsed Electric Field on Intracellular Dynamics and Function and Differences between Cancer and Normal Cells
OHTA, Nobuhiro
(National Yang Ming Chiao Tung University)





Day 3 (June 14)


9:20 - 10:25 Oral Presentations (Chair: )

3A1
Emitters in proximity of plasmonic nano-cavity
UPADHYAY, Arjun1; DAS, Bamadev2; KIM, DaiSik2; VASA, Parinda1
(1Indian Institute of Technology Bombay; 2Ulsan National Institute of Science and Technology)

IL5
Control of chemical reactions by strong coupling between plasmon nanocavities and molecules
YASUIKE, Tomokazu
(The Open University of Japan)


10:25 - 10:40 Coffee/Tea Break


10:40 - 12:10 Poster Presentations


12:10 - 13:40 Lunch Break


13:40 - 14:45 Oral Presentations (Chair: )

3A2
Mixing times of water/water and water/ethanol solutions in free impinging liquid-sheet jets
ENDO, Tomoyuki; ITAKURA, Ryuji
(Kansai Institute for Photon Science, QST)

IL6
Spectroscopic approach for vibrational polaritonic systems
KATSUKI, Hiroyuki
(Nara Institute of Science and Technology)


14:45 - 15:05 Poster Award Ceremony


15:05 - 15:10 Closing Remarks




Poster Presentations


Session 1 (June 12, 15:05 - 16:35)

1P01*
Theoretical analysis of reaction mechanism on photoisomerization of benzene oxide
CUI, Shirui1,3; NANBU, Shinkoh2,3
(1Graduate School of Science and Technology; 2Faculty of Science and Technology; 3Sophia University)

1P02*
Investigating the photo-relaxation mechanism of thymine employing nonadiabatic ab initio molecular dynamics simulations depending on electron-correlation energy
GOTO, Hinata; NANBU, Shinkoh
(Sophia University)

1P03*
The H3+ + C2H4 → H2 + C2H5+ / 2H2 + C2H3+ Reaction: Dynamics Study on a Machine-Learning Full-Dimensional Potential Energy Surface
MURAKAMI, Tatsuhiro1,2; TAKAHASHI, Soma1; KIKUMA, Yuya1; OKADA, Kunihiro2; TAKAYANAGI, Toshiyuki1
(1Saitama University, 2Sophia University)

1P04*
Machine learning analysis of post-transition state bifurcation dynamics involving proton transfer
KIKUMA, Yuya1; MURAKAMI, Tatsuhiro1,2; TAKAYANAGI, Toshiyuki1; IBUKI, Shunichi1
(1Saitama University, 2Sophia University)

1P05*
Pressure dependence of the reaction rate coefficients for OH + alkenes in mid temperature range
FUSHIMI, Ryota; OGUCHI, Tatsuo
(Toyohashi University of Technology)

1P06*
Nonadiabatic ab initio chemical reaction dynamics on photoisomerization reaction of 3,5-dimethylisoxazole via the S1 electronic state
KIMURA, Mizuki1; NANBU, Shinkoh2
(1Graduate School of Science and Technology, Sophia University; 2Faculty of Science and Technology, Sophia University)

1P07*
Deuteration effect on the temperature dependence of microscopic hydration of phenol cation
SAKAUE, Yu1; MOTO, Masatoshi1; ISHIKAWA, Haruki2
(1Graduate School of Science, Kitasato University; 2School of Science, Kitasato University)

1P08*
Development of the optical cavity for observation of gas-phase vibrational polaritons
OYAIDE, Yuma; FURUKAWA, Taiki; MITSUKAWA, Eiyu; MATSUMOTO, Yoshiteru
(Shizuoka University)

1P09*
Development of the gas cell for observation of gas-phase vibrational polaritons
FURUKAWA, Taiki; OYAIDE, Yuma; MITSUKAWA, Eiyu; MATSUMOTO, Yoshiteru
(Shizuoka University)

1P10*
Development of photo-modulated excitation method for analyzing photo-stationary states -study of p-Aminoazobenzene as an example-
INOUE, Rinka; FUKUDA, Kai; WADA, Akihide
(KOBE University)

1P11*
Development of a highly-sensitive (e,2e) electron momentum spectroscopy apparatus and its application to inner-shell ionization processes
SATO, Takumi1; KUROSU, Akane1; HASEGAWA, Tatsushi1; TAKAHASHI, Masahiko2; OHSHIMA, Yasuhiro1; YAMAZAKI, Masakazu1
(1Tokyo Institute of Technology; 2Tohoku University)

1P12*
The analysis of S1←S0 electronic transitions in Fluorene by using high-resolution laser spectroscopy; perturbation analysis in 204 cm-1 band
MINIK, Luke1; KURODA, Shinji1; KASAHARA, Shunji2
(1Graduate School of Science, Kobe University; 2Molecular Photoscience Research Center, Kobe University)

1P13*
Ultraviolet absorption spectra of purified saturated and unsaturated fatty acids and evaluation of impurities in chemical reagents
SAITO, Shota1; NUMADATE, Naoki2; TERAOKA, Hidemasa1; ENAMI, Shinichi2; KOBAYASHI, Hirokazu1; HAMA, Tetsuya1;
(1The University of Tokyo; 2University of Tsukuba)

1P14*
Measurements of Collision Energy Controlled Ion-Molecule Reactions with Pulsed Discharge and Photoionization
SAKUDA, Taro; MIYAKE, Hinata; NAKAYAMA, Keigo; YAMASAKI, Katsuyoshi; KOHGUCHI, Hiroshi
(Hiroshima University)

1P15*
Localized surface plasmon resonances of size-selected gold nanoclusters soft-landed on an organic substrate
TOKITA, Miwa; INOUE, Tomoya; NAKAJIMA, Atsushi
(Keio University)

1P16*
Development of reflection high-energy electron diffraction and infrared reflection absorption spectroscopy (RHEED-IRAS) for characterization of water ice during vapor-deposition at 120 K
SATO, Reo1; TANIGUCHI, So1; NUMADATE, Naoki2; HAMA, Tetsuya1
(1The University of Tokyo; 2Tsukuba University)

1P17*
Reactivity of single-sized Ruthenium nanoclusters on organic substrates with nitrogen molecules
SATO, Ryoichi; NISHIKAWA, Takashi; INOUE, Tomoya; NAKAJIMA, Atsushi
(Keio University)

1P18*
Investigations on the fabrication of monolithic perovskite solar cells aiming to improve their photovoltaic performance
FUKAI, Takumi; MITSUKE, Koichiro
(Grad. Sch. Sci., Josai Univ.)

1P19
Photofragment imaging of oriented methyl halide (CH3X, X=I/Br) for examining the direction of its transition dipole moment
KAWAMATA, Hiroshi1; CHE, Dock-Chil2; NAKAMURA, Masaaki3; KASAI, Toshio4
(1Hokkaido University; 2Osaka University; 3Tokyo Institute of Technology; 4National Sun Yat-sen University)





Session 2 (June 13, 15:05 - 16:35)

2P01*
Interference effects on proton momentum distributions in H2O
SAKAGUCHI, Sota; OHSHIMA, Yasuhiro; YAMAZAKI, Masakazu
(Tokyo Institute of Technology)

2P02*
Real-space quantum dynamics simulation of multi-dimensional multi-particle systems on NISQ devices
TSUOKA, Kazuki1; LÖTSTEDT, Erik1; YAMANOUCHI, Kaoru1,2
(1School of Science, The Univ. of Tokyo; 2Institute for Attosecond Laser Facility, The Univ. of Tokyo)

2P03*
Nonadiabatic dissociation dynamics of doubly photo-ionized OCS
KAMBARA, Ryuto1; TSUTSUMI, Takuro1; FURUYA, Kenji2; TAKETSUGU, Tetsuya1
(1Hokkaido University; 2Kyushu University)

2P04*
Nonadiabatic ab initio molecular dynamics for the photoisomerization pathway of 2E,4E-hexadiene on the electronically excited state, S3
CHEN, Mingchen1,3; NANBU, Shinkoh2,3
(1Graduate School of Science and Technology; 2Faculty of Science and Technology; 3Sophia University)

2P05*
Asymmetric Coulombic explosion of vibrationally excited NO2 in phase-locked two-color intense laser fields
ONO, Yuki1; HASEGAWA, Hiroka1; MATSUDA, Akitaka1; HISHIKAWA, Akiyoshi1,2
(1Grad. Sc. Sci, Nagoya U; 2RCMS, Nagoya U)

2P06*
The study of trans-stilbene S1 ← S0 transition by High-Resolution Laser Spectroscopy
Shimizu Akira1; Kasahara Shunji2; Baba Masaaki2; Nakayama Naofumi3
(1Graduate School of Science, Kobe Univ; 2Molecular PhotoScience Research Center, Kobe-Univ; 3Conflex co.)

2P07*
Kinetic study of the quenching mechanism of electronically excited Br(4p45p; 4S3/2, 2D3/2, 2D5/2) by collisions with He
KOIDE, Naoki; KAJIMOTO, Rika; OGINO, Yusuke; YAMASAKI, Katsuyoshi; KOHGUCHI, Hiroshi
(Hiroshima University)

2P08*
Tunneling electron-ion coincidence momentum imaging of UV photoexcited CH2I2
YOSHINO, Takato1; IKEYA, Daimu1; MATSUDA, Akitaka1; FUSHITANI, Mizuho1; HISHIKAWA, Akiyoshi1,2
(1Department of Chemistry, Nagoya University; 2Research Center for Materials Science, Nagoya University)

2P09*
High-resolution Laser spectroscopy of S1-S0 electronic transition of carbazole
OOIWAMOTO, Shota1; UEDA Shoya1; KURODA Shinji1; KASAHARA Shunji1,2
(1Graduate School of Science, Kobe University; 2Molecular Photoscience Research Center, Kobe University)

2P10*
Study on Hydrogen bonds of propargyl alcohol clusters by IR spectroscopy and quantum chemical calculations
HAYANO, Yuki; MATSUMOTO, Yoshiteru
(Shizuoka University)

2P11*
Absorption cross section of dangling OH bonds in amorphous ice at 20 K
HASEGAWA, Takeshi1; YANAGISAWA, Hiroto1; NAGASAWA, Takumi1,2; NUMADATE, Naoki3; HAMA, Tetsuya1
(1The University of Tokyo; 2Univ. Grenoble-Alpes; 3University of Tsukuba)

2P12*
Experimental determination of intermolecular vibrational wavefunctions in argon dimers by wave-packet imaging
MURAI, Tomomi1; YOSHIZAWA, Nanaho2; SATO, Urara2; MIZUSE, Kenta1,2; OHSHIMA, Yasuhiro1
(1Tokyo Institute of Technology; 2Kitasato University)

2P13*
Theoretical study on excited-state dynamics of salicylideneaniline in crystalline phase
KOMURO, Hiroto1; SAITA, Kenichiro2; TAKETSUGU, Tetsuya2,3
(1Grad. Sch. Chem. Sci. Eng., Hokkaido Univ.; 2Fac. Sci., Hokkaido Univ.; 3WPI-ICReDD, Hokkaido Univ.)

2P14*
Bayesian Optimization for Efficient Exploration of Highly Enantioselective Reaction by Dynamic Feature Selection
HASHIBA, Shunnichi1; KITANO, Tomoyuki1; TABATA, Koji1; MATSUMURA, Yoshihiro1; TERAYAMA, Kei2; KOMATSUZAKI, Tamiki1
(11Hokkaido University; 2Yokohama City University)

2P15*
UV-Vis photodissociation processes of O4+ studied by ion imaging experiments and theoretical calculations
WATABE, Yu; KOSHIBA, Takumi; ITO, Yuri; KANNO, Manabu; OHSHIMO, Keijiro; MISAIZU, Fuminori
(Graduate School of Science, Tohoku Univ.)

2P16*
Light-induced rotational wave-packet dynamics of carbon monoxide by superconducting-type and trapped-ion-type quantum computers
TOBINAGA, Kotomi1; LÖTSTEDT, Erik1; YAMANOUCHI, Kaoru1,2
(1School of Science, The Univ. of Tokyo; 2Institute for Attosecond Laser Facility, The Univ. of Tokyo)

2P17*
Proton Transfer Reaction via Vehicle Mechanism: Rate Constants and Intermediate in Ion-Molecule Reactions of p-Aminobenzoic Acid and NH3
TSUNODA, Kengo; FUSE, Daiki; OHSHIMO, Keijiro; MISAIZU, Fuminori
(Graduate School of Science, Tohoku University)

2P18*
Ab initio MD simulation of excited state dynamics of cyanine dye 1122C in solution
MINEGISHI, Yusuke1; SAITA, Kenichiro2; TSUTSUMI, Takuro2; TAKETSUGU, Tetsuya2,3
(1Grad. Sch. Chem. Sci. Eng., Hokkaido Univ.; 2Fac. Sci., Hokkaido Univ.; 3WPI-ICReDD, Hokkaido Univ.)

2P19
Study for Carbon K‐Edge Spectra of Firefly Luciferin
KUDO, Yuto1; KUMAKI, Fumitoshi2,3; NAGASAKA, Masanari2,4; ADACHI, Jun-ichi2,3; NOGUCHI, Yoshifumi5; KOGA, Nobuaki6; ITABASHI, Hideyuki1; HIYAMA, Miyabi1
(1Gunma University; 2SOKENDAI; 3KEK; 4IMS; 5Shizuoka University; 6Nagoya University)





Session 3 (June 14, 10:40 - 12:10)

3P01
Theoretical and experimental OD-stretch vibrational spectroscopy of heavy water
YAMAGUCHI, Shoichi; TAKAYAMA, Tetsuyuki; OTOSU, Takuhiro
(Saitama University)

3P02
Symplectic integrator approach to propagation of ultrashort light pulses in dispersive media
SAKO, Tokuei
(Nihon University)

3P03
Shock tube study of the pressure dependence of neopentane pyrolysis
YASUNAGA, Kenji; MORIYAMA, Hiroto; YAMANAKA, Nobutaka; YAMADA, Hiroshi
(National Defense Academy)

3P04
(Moved to 1P19)

3P05
Observation of spatially oriented iodomethane state-selected by a Stark deflector
KONDO, Ryo; NAKAMURA, Masaaki; OHSHIMA, Yasuhiro
(Tokyo Institute of Technology)

3P06
Angular momentum projection analysis of superatomic orbitals formed in doped- and undoped-silver cluster anions
SUZUKI, Yuta; MATSUMURA, Daiki; TERASAKI, Akira; HORIO, Takuya
(Kyushu University)

3P07
Generation of sub-10 fs deep UV and extreme UV radiation for time-resolved photoelectron spectroscopy
KARASHIMA, Shutaro; CHEN, Chih-Jen; SUZUKI, Toshinori
(Kyoto University)

3P08
High-Resolution Laser Spectroscopy of A-X Transition of NO2: Anomalies in the 16218 cm-1 band
KASAHARA, Shunji1; TORAO, Sakura2; MINAMIDE, Honoka2; YOSHIZAWA, Takumi2; TADA, Kohei3
(1Molecular Photoscience Research Center, Kobe University; 2Faculty of Science, Kobe University; 3Graduate School of Engineering, Kyoto University)

3P09
Electronic Relaxation of Aqueous Uracil and Thymine Studied by Time-Resolved Infrared Spectroscopy
OBARA, Yuki; GHOSH, Srijon; HUMENIUK, Alexander; KAMIBASHIRA, Shota; SUZUKI, Toshinori
(Kyoto university)

3P10
Comprehensive study on hydrogen abstraction reactions from hydrazine derivatives
KANNO, Nozomu
(Meijo University)

3P11
Multi-electron-ion coincidence spectroscopy of I 4d inner-shell photoionization of CH3I and CH2I2
FUSHITANI, Mizuho1; HIKOSAKA, Yasumasa2; TASHIRO, Motomichi3; HISHIKAWA, Akiyoshi1
(1Nagoya University, 2University of Toyama, 3Toyo University)

3P12
(Withdrawn)

3P13
Transient luminescence studies for excited-state kinetics of organic indoline dyes adsorbed on nanocrystalline TiO2 films
IE, Kanon; MITSUKE, Koichiro
(Grad. Sch. Sci., Josai Univ.)

3P14
Photochemical reaction of anthracene with CCl4 in alcohols
WATANABE, Akihiro1; NAKATANI, Takeomi2
(1Kobe City College of Technology; 2Hokkaido University)

3P15
Non-adiabatic excited-state time-dependent GW molecular dynamics for an accurate description of chemical reactions
MANJANATH, Aaditya1; SAHARA, Ryoji1; OHNO, Kaoru2; KAWAZOE, Yoshiyuki3
(1National Institute for Materials Science; 2Yokohama National University; 3Tohoku University)