Y. Kurosaki

发表

Three-dimensional quantum reactive scattering calculations for the nonadiabatic (D+H2)+ reaction system

A. Ichihara, T. Takayanagi, Y. Kurosaki, 2000 .

Quantum control study of multilevel effect on ultrafast isotope-selective vibrational excitations.

Keiichi Yokoyama, K. Yokoyama, Y. Kurosaki, 2009, The Journal of chemical physics.

Quantum optimal control of isomerization dynamics of a one-dimensional reaction-path model dominated by a competing dissociation channel.

Herschel Rabitz, Tak-San Ho, Maxim Artamonov, 2009, The Journal of chemical physics.

Kinetics and mechanisms of the reactions of CH and CD with H2S and D2S

Kei Sato, T. Takayanagi, Y. Kurosaki, 1999 .

Quantum optimal control for the full ensemble of randomly oriented molecules having different field-free Hamiltonians.

A. Ichihara, K. Yokoyama, Y. Kurosaki, 2011, The Journal of chemical physics.

van der Waals resonances in cumulative reaction probabilities for the F+H2,D2, and HD reactions

T. Takayanagi, Y. Kurosaki, 1998 .

Tunneling in the F+H2 reaction and its isotopic variants: the effect of the Van der Waals potential

T. Takayanagi, Y. Kurosaki, 1998 .

Hydrogen-atom production channels of acetaldehyde photodissociation: Direct DFT molecular dynamics study

Y. Kurosaki, 2008 .

Photodissociation of acetaldehyde, CH3CHO → CH4+ CO: II. Direct ab initio molecular dynamics study

Y. Kurosaki, 2006 .

Ab initio molecular orbital study of potential energy surface for the H2NO(2B1)→NO(2Π)+H2 reaction

T. Takayanagi, Y. Kurosaki, 2000 .

Quantum scattering calculations for the electronically nonadiabatic Br(2P1/2)+H2→HBr+H reaction

T. Takayanagi, Y. Kurosaki, 2000 .

Quantum-mechanical tunneling in the H2 elimination from 2,3-dimethylbutane cation: (CH3)2CHCH(CH3)+2→(CH3)2CC(CH3)+2+H2. An ab initio molecular orbital study

T. Miyazaki, T. Takayanagi, Y. Kurosaki, 1998 .

THEORETICAL CALCULATIONS OF POTENTIAL ENERGY SURFACE AND THERMAL RATE CONSTANTS FOR THE H(MU) + F2 REACTION

T. Takayanagi, Y. Kurosaki, 1997 .

Ab initio MRCI study on potential energy surfaces for double Cl loss from the palladium tetrachloride anion PdCl42−

Y. Kurosaki, H. Ohba, M. Saeki, 2021, Chemical Physics Letters.

Ab initio study of palladium dichloride PdCl2 and its anion PdCl2−

Y. Kurosaki, H. Ohba, M. Saeki, 2021, Chemical Physics.

Theoretical calculations of the prereaction process of the H-...HD van der Waals molecule

T. Takayanagi, Y. Kurosaki, 2000 .

Direct ab initio classical trajectory calculations for the N(2D)+CH4 insertion reaction

T. Takayanagi, Y. Kurosaki, 1999 .

Application of ab initio direct dynamics calculations on the ionization and electron attachment processes for the CCl3F molecule

H. Tachikawa, T. Takayanagi, Y. Kurosaki, 1998 .

KINETIC STUDIES ON THE N(2D, 2P) + CH4 AND CD4 REACTIONS : THE ROLE OF NONADIABATIC TRANSITIONS ON THERMAL RATE CONSTANTS

Kei Sato, T. Takayanagi, Y. Kurosaki, 1999 .

Production processes of H(D) atoms in the reactions of NO() with C2H2, C2H4, H2O, and their isotopic variants

H. Umemoto, K. Yokoyama, T. Takayanagi, 2000 .

Ab initio study on the ground and low-lying excited states of cesium iodide (CsI).

L. Matsuoka, K. Yokoyama, Y. Kurosaki, 2008, The Journal of chemical physics.

Ab initio study on the low-lying potential energy curves of the diatomic cesium iodide cation (CsI+)

K. Yokoyama, Y. Kurosaki, 2012 .

Ab initio MRSDCI study on the low-lying electronic states of the lithium chloride molecule (LiCl).

K. Yokoyama, Y. Kurosaki, 2012, The Journal of chemical physics.

Quantum control of isotope-selective molecular orientation

K. Yokoyama, Y. Kurosaki, Y. Ohtsuki, 2022, INTERNATIONAL CONFERENCE OF COMPUTATIONAL METHODS IN SCIENCES AND ENGINEERING ICCMSE 2021.

Theoretical Study on Isotope-Selective Dissociation of the Lithium Chloride Molecule Using a Designed Terahertz-Wave Field

L. Matsuoka, A. Ichihara, K. Yokoyama, 2014 .

Theoretical calculations of thermal rate constants for the N(2D)+acetylene reaction

Kei Sato, K. Yokoyama, T. Takayanagi, 1999 .

Ab initio MRCI study on potential energy curves for a single Cl loss from the palladium tetrachloride anion PdCl42−

Y. Kurosaki, H. Ohba, M. Saeki, 2020 .

Silyl radical mechanisms for silicon-nitrogen bond formation

K. Yamaguchi, T. Yamabe, S. Kawauchi, 1992 .

Potential energy surface for the C 2 H 4 +Cl 2 →C 2 H 4 Cl+Cl reaction: ab initio molecular orbital study

Y. Kurosaki, 2001 .

Ab initio molecular orbital study of the reaction

Y. Kurosaki, 2000 .

Ab initio MO calculations on potential energy surfaces of CCl4, is a C2v contact ion pair an isomer of Td–CCl4?

H. Tachikawa, T. Takayanagi, Y. Kurosaki, 1999 .

Coherent correlation between nonadiabatic rotational excitation and angle-dependent ionization of NO in intense laser fields.

Y. Kurosaki, H. Hasegawa, A. Yokoyama, 2010, The journal of physical chemistry. A.

Isotope effects on the spin-density distribution in the H 6 + clusters: Direct ab initio molecular dynamics study

J. Kumagai, Yuta Shimizu, Y. Kurosaki, 2008 .

Theoretical study of kinetic isotope effects on rate constants for the H2+C2H→H+C2H2 reaction and its isotopic variants

T. Takayanagi, Y. Kurosaki, 2000 .

Theoretical study of an isotope effect on rate constants for the CH3+H2→CH4+H and CD3+H2→CD3H+H reactions using variational transition state theory and the multidimensional semiclassical tunneling method

T. Takayanagi, Y. Kurosaki, 1999 .

A direct isomerization path for the H6+ cluster.: An ab initio molecular orbital study

T. Takayanagi, Y. Kurosaki, 1998 .

An ab initio molecular orbital study of even-membered hydrogen cluster cations: H6+, H8+, H10+, H12+, and H14+

T. Takayanagi, Y. Kurosaki, 1998 .

Photodissociation of acetaldehyde, CH3CHO → CH3+ HCO: direct ab initio molecular dynamics study

K. Yokoyama, Y. Kurosaki, 2003 .

A modified version of the analytical potential function for the global ab initio ground-state potential energy surface of the BrH2 system

T. Takayanagi, Y. Kurosaki, 2005 .

Global ab initio potential energy surfaces for the lowest three doublet states (1 2A′, 2 2A′, and 1 2A″) of the BrH2 system

T. Takayanagi, Y. Kurosaki, 2003 .

Ab initio molecular orbital calculations of potential energy surfaces for the N(4S, 2D, 2P)+H2 reactions

K. Yokoyama, T. Takayanagi, Y. Kurosaki, 2000 .

Ab initio molecular orbital study on the H2 loss reaction from ethane cation, C2H6+

T. Takayanagi, Y. Kurosaki, 1997 .

Direct ab initio molecular dynamics study of the two photodissociation channels of formic acid

K. Yokoyama, Y. Kurosaki, Y. Teranishi, 2005 .

Ab Initio Molecular Orbital Calculations for the N(2D) + Ethylene Reaction

Kei Sato, T. Takayanagi, Y. Kurosaki, 1998 .

Hydration Structures of the Human Protein Kinase CK2α Clarified by Joint Neutron and X-ray Crystallography.

T. Kinoshita, R. Kuroki, Y. Kurosaki, 2018, Journal of molecular biology.

An Analytic Formula for Describing the Transient Rotational Dynamics of Diatomic Molecules in an Optical Frequency Comb

L. Matsuoka, A. Ichihara, K. Yokoyama, 2013 .

Quantum control study of ultrafast isotope-selective vibrational excitations of the cesium iodide (CsI) molecule

K. Yokoyama, Y. Kurosaki, A. Yokoyama, 2011 .

Multilevel effect on ultrafast isotope-selective vibrational excitations: Quantum optimal control study

K. Yokoyama, Y. Kurosaki, A. Yokoyama, 2009 .

Quantum optimal control pathways of ozone isomerization dynamics subject to competing dissociation: a two-state one-dimensional model.

H. Rabitz, T. Ho, Y. Kurosaki, 2014, The Journal of chemical physics.

Energy-flow dynamics in the molecular channel of propanal photodissociation, C2H5CHO --> C2H6 + CO: direct ab initio molecular dynamics study.

Y. Kurosaki, 2006, The journal of physical chemistry. A.

AB INITIO MOLECULAR ORBITAL CALCULATIONS OF THE POTENTIAL ENERGY SURFACES FOR THE N(2D) + CH4 REACTION

Kei Sato, T. Takayanagi, Y. Kurosaki, 1998 .

Ab initio molecular orbital study of the O(1D) insertion into the C–C bond in cyclopropane and ethane

T. Takayanagi, Y. Kurosaki, 2002 .

Quantum Optimal Control of Rovibrational Excitations of a Diatomic Alkali Halide: One-Photon vs. Two-Photon Processes

K. Yokoyama, Y. Kurosaki, 2019, Universe.

Reaction pathways for palladium(I) reduction in laser-induced particle formation of Pd: An ab initio molecular orbital study

Y. Kurosaki, H. Ohba, M. Saeki, 2023, Chemical Physics.

REACTIONS OF N(22D) WITH CH3OH AND ITS ISOTOPOMERS

H. Umemoto, T. Takayanagi, Y. Kurosaki, 1999 .

Quantum optimal control of the isotope-selective rovibrational excitation of diatomic molecules

K. Yokoyama, Y. Kurosaki, 2017 .

A theoretical study on an isotope effect in the CH3+H2 → CH4+H reaction

T. Takayanagi, Y. Kurosaki, 1999 .

Theoretical study of the non-Arrhenius temperature dependence of thermal rate constants for the H+H2S→H2+SH reaction

T. Takayanagi, Y. Kurosaki, 1999 .

Local model calculation for fluorination process in thermal etching of Si

T. Yamabe, S. Kawauchi, Y. Kurosaki, 1991 .