I. Ohmine

发表

Molecular dynamics simulation of the ice nucleation and growth process leading to water freezing

Shinji Saito, Masakazu Matsumoto, S. Saito, 2002, Nature.

Potential energy surfaces for water dynamics. II. Vibrational mode excitations, mixing, and relaxations

Hideki Tanaka, Hideki Tanaka, Iwao Ohmine, 1990 .

Topological building blocks of hydrogen bond network in water.

M. Matsumoto, I. Ohmine, A. Baba, 2007, The Journal of chemical physics.

Photoisomerization of polyenes: Potential energy surfaces and normal mode analysis

K. Morokuma, I. Ohmine, 1980 .

Fifth-order two-dimensional Raman spectroscopy of liquid water, crystalline ice Ih and amorphous ices: sensitivity to anharmonic dynamics and local hydrogen bond network structure.

S. Saito, I. Ohmine, 2006, The Journal of chemical physics.

Dynamics and relaxation of an intermediate size water cluster (H2O)108

S. Saito, I. Ohmine, 1994 .

Off-resonant two-dimensional fifth-order Raman spectroscopy of liquid CS2: Detection of anharmonic dynamics

S. Saito, I. Ohmine, 2003 .

Dynamics of proton attachment to water cluster: Proton transfer, evaporation, and relaxation

S. Saito, I. Ohmine, C. Kobayashi, 1996 .

Proton Transfer in Liquid Water II; A Semiempirical Method to Describe Chemical Reactions

T. Komatsuzaki, I. Ohmine, 1996 .

Frequency increase of the C:C ag stretch mode of polyenes in the 21Ag- state: ab initio MCSCF study of butadiene, hexatriene, and octatetraene

M. Aoyagi, I. Ohmine, B. Kohler, 1990 .

Ab initio molecular orbital study on the thermostability of the extreme thermophile tRNA: role of the base stacking.

M. Aida, K. Morokuma, I. Ohmine, 1982, Journal of theoretical biology.

Frequency dependence of specific heat in supercooled liquid water and emergence of correlated dynamics.

B. Bagchi, S. Saito, I. Ohmine, 2013, The Journal of chemical physics.

Effects of nonadditive interactions on ion solvation at the water/vapor interface: a molecular dynamics study.

S. Saito, I. Ohmine, T. Yagasaki, 2010, The journal of physical chemistry. A.

Off-resonant fifth-order response function for two-dimensional Raman spectroscopy of liquids CS2 and H2O.

S. Saito, I. Ohmine, 2002, Physical review letters.

Erratum: “Mechanism of fast proton transfer in ice: Potential energy surface and reaction coordinate analyses” [J. Chem. Phys. 113, 9090 (2000)]

S. Saito, I. Ohmine, C. Kobayashi, 2001 .

Phase Separation and Gelation in Gelatin Gels

Toyoichi Tanaka, Gerald Swislow, I. Ohmine, 1979 .

Nanosecond laser photolysis of the benzene monomer and eximer

K. Yoshihara, N. Nakashima, I. Ohmine, 1980 .

Renormalized configuration interaction method for electron correlation in the excited states of polyenes

Klaus Schulten, Martin Karplus, M. Karplus, 1978 .

Fluctuation, relaxations, and hydration in liquid water. Hydrogen-bond rearrangement dynamics

Hideki Tanaka, Hideki Tanaka, Iwao Ohmine, 1993 .

Correlation effects in the spectra of polyenes

Klaus Schulten, Martin Karplus, M. Karplus, 1976 .

Photoisomerization of polyenes: Potential energy surfaces and normal mode analysis

K. Morokuma, I. Ohmine, 1980 .

Energy dissipation mechanism of the optically excited molecules in solvents: A trajectory study for a photoisomerization process of the π‐conjugated molecule in Ar and water

I. Ohmine, 1986 .

Mechanisms of nonadiabatic transitions in photoisomerization processes of conjugated molecules: Role of hydrogen migrations

Iwao Ohmine, I. Ohmine, 1985 .

Photoisomerization of polyenes; reaction coordinate and trajectory in triplet mechanism

K. Morokuma, I. Ohmine, 1981 .

Instantaneous normal mode analysis of liquid water

G. Fleming, S. Saito, M. Cho, 1994 .

Rearrangements of model (H2O)8 and (H2O)20 clusters

D. Wales, I. Ohmine, 1993 .

Nonadiabatic transition and energy relaxation dynamics in the photoisomerization of s-trans butadiene

Masakatsu Ito, Masakatsu Ito, Iwao Ohmine, 1997 .

Mechanism of proton transfer in ice. II. Hydration, modes, and transport

Chigusa Kobayashi, Shinji Saito, S. Saito, 2001 .

Gradient Embedded Genetic Algorithm (GEGA)

Amar M. Kamat, M. Barbatti, M. Ruckenbauer, 2010 .

Relaxations, Fluctuations, Phase Transitions and Chemical Reactions in Liquid Water

M. Sasai, I. Ohmine, 1991 .

Dynamical Behavior of Water; Fluctuation, Reactions and Phase Transitions

S. Saito, I. Ohmine, 2021, Bulletin of the Chemical Society of Japan.

Large local energy fluctuations in water

Hideki Tanaka, Hideki Tanaka, Iwao Ohmine, 1987 .

Proton Transfer in Bacteriorhodopsin: Structure, Excitation, IR Spectra, and Potential Energy Surface Analyses by an ab Initio QM/MM Method

Iwao Ohmine, I. Ohmine, Shigehiko Hayashi† and, 2000 .

Cluster configuration method: application to the spectra of π-electron systems

I. Ohmine, 1980 .

Large local energy fluctuations in water. II. Cooperative motions and fluctuations

Peter G. Wolynes, Hideki Tanaka, P. Wolynes, 1988 .

Salt effects on the phase transition of ionic gels

Toyoichi Tanaka, Iwao Ohmine, I. Ohmine, 1982 .

A theoretical study on decomposition of formic acid in sub- and supercritical water

S. Saito, I. Ohmine, T. Yagasaki, 2002 .

Structure, dynamics, and thermodynamics of model (H2O)8 and (H2O)20 clusters

D. Wales, I. Ohmine, 1993 .

A new approach to the dynamics of hydrogen bond network in liquid water

M. Matsumoto, I. Ohmine, 1996 .

Mechanism of fast proton transfer in ice: Potential energy surface and reaction coordinate analyses

Chigusa Kobayashi, Shinji Saito, S. Saito, 2000 .

Fluctuation, relaxation and rearrangement dynamics of a model (H2O)20 cluster: Non-statistical dynamical behavior

D. Wales, S. Saito, I. Ohmine, 1997 .

Energetics of proton transfer in liquid water. I. Ab initio study for origin of many-body interaction and potential energy surfaces

T. Komatsuzaki, I. Ohmine, 1994 .

Crucial role of fragmented and isolated defects in persistent relaxation of deeply supercooled water.

B. Bagchi, S. Saito, I. Ohmine, 2018, The Journal of chemical physics.

Liquid Water Dynamics: Collective Motions, Fluctuation, and Relaxation

I. Ohmine, 1995 .

Potential energy surfaces for water dynamics: Reaction coordinates, transition states, and normal mode analyses

Hideki Tanaka, Hideki Tanaka, Iwao Ohmine, 1989 .

Long time fluctuation of liquid water: 1/f spectrum of energy fluctuation in hydrogen bond network rearrangement dynamics

R. Ramaswamy, M. Sasai, I. Ohmine, 1992 .

A theoretical study on anomalous temperature dependence of pKw of water.

S. Saito, I. Ohmine, T. Yagasaki, 2005, The Journal of chemical physics.

Instantaneous normal mode analysis of orientational motions in liquid water : Local structural effects

G. Fleming, S. Saito, M. Cho, 2015 .

Translational and orientational dynamics of a water cluster (H2O)108 and liquid water: Analysis of neutron scattering and depolarized light scattering

S. Saito, I. Ohmine, 1995 .

Off-resonant fifth-order nonlinear response of water and CS2: Analysis based on normal modes

S. Saito, I. Ohmine, 1998 .

Third order nonlinear response of liquid water

S. Saito, I. Ohmine, 1997 .

Landscape of Water Dynamics and Chemical Reactions

S. Saito, M. Matsumoto, I. Ohmine, 2002 .

A molecular dynamics study for the structure determination of the signaling state in the photocycle of photoactive yellow protein.

M. Kamiya, I. Ohmine, 2010, The journal of physical chemistry. B.

Proton transfer and associated molecular rearrangements in the photocycle of photoactive yellow protein: role of water molecular migration on the proton transfer reaction.

S. Saito, M. Kamiya, I. Ohmine, 2007, Journal of Physical Chemistry B.

Defect pair separation as the controlling step in homogeneous ice melting

M. Matsumoto, I. Ohmine, K. Mochizuki, 2013, Nature.