Kazuaki Toyoura
Kazuaki Toyoura
Verified email at kyoto-u.ac.jp
Title
Cited by
Cited by
Year
First-principles approach to chemical diffusion of lithium atoms in a graphite intercalation compound
K Toyoura, Y Koyama, A Kuwabara, F Oba, I Tanaka
Physical Review B 78 (21), 214303, 2008
1462008
Optical properties of zinc nitride formed by molten salt electrochemical process
K Toyoura, H Tsujimura, T Goto, K Hachiya, R Hagiwara, Y Ito
Thin Solid Films 492 (1-2), 88-92, 2005
832005
Direct Imaging of Pt Single Atoms Adsorbed on TiO2 (110) Surfaces
TY Chang, Y Tanaka, R Ishikawa, K Toyoura, K Matsunaga, Y Ikuhara, ...
Nano letters 14 (1), 134-138, 2014
812014
Effects of Off-Stoichiometry of LiC6 on the Lithium Diffusion Mechanism and Diffusivity by First Principles Calculations
K Toyoura, Y Koyama, A Kuwabara, I Tanaka
The Journal of Physical Chemistry C 114 (5), 2375-2379, 2010
732010
Proton mobility through a second order phase transition: theoretical and experimental study of LaNbO 4
H Fjeld, K Toyoura, R Haugsrud, T Norby
Physical Chemistry Chemical Physics 12 (35), 10313-10319, 2010
592010
Machine-learning-based selective sampling procedure for identifying the low-energy region in a potential energy surface: A case study on proton conduction in oxides
K Toyoura, D Hirano, A Seko, M Shiga, A Kuwabara, M Karasuyama, ...
Physical Review B 93 (5), 054112, 2016
472016
Defect chemistry of a BaZrO 3 Σ3 (111) grain boundary by first principles calculations and space–charge theory
JM Polfus, K Toyoura, F Oba, I Tanaka, R Haugsrud
Physical Chemistry Chemical Physics 14 (35), 12339-12346, 2012
402012
Proton-conducting network in lanthanum orthophosphate
K Toyoura, N Hatada, Y Nose, I Tanaka, K Matsunaga, T Uda
The Journal of Physical Chemistry C 116 (36), 19117-19124, 2012
382012
Atomic sites and stability of Cs+ captured within zeolitic nanocavities
K Yoshida, K Toyoura, K Matsunaga, A Nakahira, H Kurata, YH Ikuhara, ...
Scientific reports 3, 2457, 2013
272013
First-principles analysis of oxide-ion conduction mechanism in lanthanum silicate
K Matsunaga, K Toyoura
Journal of Materials Chemistry 22 (15), 7265-7273, 2012
272012
First-principles calculations of divalent substitution of Ca2+ in tricalcium phosphates
K Matsunaga, T Kubota, K Toyoura, A Nakamura
Acta biomaterialia 23, 329-337, 2015
212015
Exploring a potential energy surface by machine learning for characterizing atomic transport
K Kanamori, K Toyoura, J Honda, K Hattori, A Seko, M Karasuyama, ...
Physical Review B 97 (12), 125124, 2018
192018
Fast and anisotropic proton conduction in a crystalline polyphosphate
N Hatada, K Toyoura, T Onishi, Y Adachi, T Uda
The Journal of Physical Chemistry C 118 (51), 29629-29635, 2014
182014
First-principles thermodynamics of La 2 O 3-P 2 O 5 pseudobinary system
K Toyoura, N Hatada, Y Nose, T Uda, I Tanaka
Physical Review B 84 (18), 184301, 2011
182011
First-principles study on phase transition and ferroelectricity in lithium niobate and tantalate
K Toyoura, M Ohta, A Nakamura, K Matsunaga
Journal of Applied Physics 118 (6), 064103, 2015
172015
First-Principles Analysis of Proton Conduction Mechanism in Pyrochlore-Structured Lanthanum Zirconate
K Toyoura, A Nakamura, K Matsunaga
The Journal of Physical Chemistry C 119 (16), 8480-8487, 2015
172015
Formation and control of zinc nitride in a molten LiCl–KCl–Li3N system
T Goto, K Toyoura, H Tsujimura, Y Ito
Materials Science and Engineering: A 380 (1-2), 41-45, 2004
162004
Stable sites and diffusion pathways of interstitial oxide ions in lanthanum germanate
K Imaizumi, K Toyoura, A Nakamura, K Matsunaga
Solid State Ionics 262, 512-516, 2014
152014
Structural and optical properties of magnesium nitride formed by a novel electrochemical process
K Toyoura, T Goto, K Hachiya, R Hagiwara
Electrochimica acta 51 (1), 56-60, 2005
152005
Nitrogen and hydrogen defect equilibria in Ca 12 Al 14 O 33: a combined experimental and computational study
JM Polfus, K Toyoura, CH Hervoches, MF Sunding, I Tanaka, R Haugsrud
Journal of Materials Chemistry 22 (31), 15828-15835, 2012
142012
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Articles 1–20