TATEYAMA, Yoshitaka

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Last Update : 2015/02/07
TATEYAMA, Yoshitaka
Group Leader,  Interface Computational Science Group, C4GR,  National Institute for Materials Science
Email: TATEYAMA.Yoshitakanims.go.jp
Phone: +81-29-859-2626
1-1 Namiki, Tsukuba, Ibaraki, 305-0044 JAPAN [Location]
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Other Affiliations
Principal Researcher, Ad hoc Team on Perovskite PV Cells, C4GR-GREEN
Principal Researcher, Battery Materials Group, CMI2
Principal Researcher, Data Science Group, CMI2
Research fields
Keywords DFT, free energy calculation, redox reaction, photoexcitation, solid-liquid interface, battery, solar cell, catalysis
Publications NIMS affiliated publications since 2004.
Research papers
  • K. Ushirogata, K. Sodeyama, Y. Okuno, Y. Tateyama : “Additive Effect on Reductive Decomposition and Binding of Carbonate-Based Solvent toward Solid Electrolyte Interphase Formation in Lithium-Ion Battery” J. Am. Chem. Soc. 135[32] (2013) 11967-11974 DOI:10.1021/ja405079s
  • Z. Futera, K. Sodeyama, J. V. Burda, Y. Einaga, Y. Tateyama : “A double-QM/MM method for investigating donor–acceptor electron-transfer reactions in solution” Phys. Chem. Chem. Phys. 16[36] (2014) 19530-19539 DOI:10.1039/c4cp02307b
  • J. Haruyama, K. Sodeyama, L. Han, Y. Tateyama : “Termination Dependence of Tetragonal CH3NH3PbI3 Surfaces for Perovskite Solar Cells” Phys. Chem. Lett 5[16] (2014) 2903-2909 DOI:10.1021/jz501510v
  • Y. Tateyama, T. Ohno : “First-Principles Study on the Stability of Vacancy-Hydrogen complexes in alpha-iron” Hydrogen effects on material behavior and corrosion deformation interactions (2003)
Presentations, others
  • Aug. 10-14, 2014 : Y. Tateyama : “Additive effect on initial stage of solid electrolyte interphase (SEI) formation in lithium ion battery” 248th ACS National Meeting & Exposition
  • Sep. 10-12, 2014 : Y. Tateyama : “DFT-MD Simulations Reveal Novel Reaction Mechanisms of Electrolyte toward SEI formation in LIB” The 3rd TYC Energy Materials Workshop
  • Feb. 15, 2014 : 館山佳尚 : “「京」で行う充電池材料開発〜スマホから電気自動車に向けて〜” スーパーコンピュータ「京」を知る集いin熊本
External references
ResearcherID.COM (No.H-2715-2011)
Society membership Japan Physical Society, American Chemical Society
NIMS Researchers