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
MANA Principal Investigator, International Center for Materials Nanoarchitectonics
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