Structure and ionic conductivity of Li2S–P2S5 glass electrolytes simulated with first-principles molecular dynamics T Baba, Y Kawamura
Frontiers in Energy Research 4, 22, 2016
39 2016 DFT calculation analysis of the infrared spectra of ethylene adsorbed on Cu (110), Pd (110), and Ag (110) K Itoh, T Kiyohara, H Shinohara, C Ohe, Y Kawamura, H Nakai
The Journal of Physical Chemistry B 106 (41), 10714-10721, 2002
37 2002 A hybrid approach combining energy density analysis with the interaction energy decomposition method Y Kawamura, H Nakai
Journal of computational chemistry 25 (15), 1882-1887, 2004
32 2004 Energy density analysis of cluster size dependence of surface-molecule interactions: H Nakai, M Katouda, Y Kawamura
The Journal of chemical physics 121 (10), 4893-4900, 2004
31 2004 π*–σ* Hyperconjugation mechanism on the rotational barrier of the methyl group (II): 1-and 2-methylnaphthalenes in the S0, S1, C0, and A1 states H Nakai, Y Kawamura
Chemical Physics Letters 318 (4-5), 298-304, 2000
24 2000 Electrochemical reduction of an anion for ionic-liquid molecules on a lithium electrode studied by first-principles calculations Y Ando, Y Kawamura, T Ikeshoji, M Otani
Chemical Physics Letters 612, 240-244, 2014
23 2014 Energy density analysis of internal methyl rotations in halogenated toluenes Y Kawamura, H Nakai
Chemical physics letters 368 (5-6), 673-679, 2003
22 2003 Energy density analysis of embedded cluster models for an MgO crystal Y Kawamura, H Nakai
Chemical physics letters 410 (1-3), 64-69, 2005
20 2005 Li-ion transport at the interface between a graphite anode and Li 2 CO 3 solid electrolyte interphase: ab initio molecular dynamics study T Baba, K Sodeyama, Y Kawamura, Y Tateyama
Physical Chemistry Chemical Physics 22 (19), 10764-10774, 2020
15 2020 Y Kawamura, T Nagasawa, H Nakai
The Journal of Chemical Physics 114 (19), 8357-8363, 2001
13 2001 Application of abstract interpretation to the automotive electronic control system T Yamaguchi, M Brain, C Ryder, Y Imai, Y Kawamura
International Conference on Verification, Model Checking, and Abstract …, 2019
12 2019 Theoretical analysis of the oxidation potentials of organic electrolyte solvents M Okoshi, A Ishikawa, Y Kawamura, H Nakai
ECS Electrochemistry Letters 4 (9), A103, 2015
9 2015 Theoretical study of particle size effect on oxygen reduction reaction on Pt catalyst Y Kawamura, R Jinnouchi
ECS Transactions 50 (2), 1321, 2013
5 2013 Electrolyte solution for lithium metal battery, and lithium metal battery H Nakamoto, Y Kawamura
US Patent App. 14/221,830, 2014
2 2014 Application of abstract interpretation to the automotive electronic control system M Nyx Brain, T Yamaguchi, M Brain, C Ryder, Y Imai, Y Kawamura
Springer, 2019
2019 Lithium secondary battery and method for producing same J Yoshida, K Nobuhara, Y Kawamura
US Patent 9,882,218, 2018
2018 DFT-MD Study of Interface Between Carbon Anode and Amorphous Lithium Carbonate Y Kawamura, T Baba, N Takahashi, K Sodeyama, Y Tateyama
ECS Meeting Abstracts, 571, 2016
2016 First Principle Based Simulation of Cyclic Voltammogram: Bromide Adsorption on Pt (111) Surface Y Kawamura, T Baba
ECS Meeting Abstracts, 1338, 2014
2014 Theoretical Study on Particle Size effect of Oxygen Reduction Reaction on Pt Catalyst Y Kawamura, R Jinnouchi
ECS Meeting Abstracts, 1519, 2012
2012 Search for a Realistic Orbifold Grand Unification Y Kawamura
AIP Conference Proceedings 1015 (1), 159-177, 2008
2008 