Our group member gave 2 oral at international congress DFT2019 in Spain

Our group member gave 2 oral at international congress DFT2019 in Spain.

Date: July 22-26, 2019
Place: Alicante, Spain

口頭発表

  • ○T. M. Maier, Y. Ikabata, H. Nakai, "Local Hybrid Functionals for Relativistic 1s Core Orbital Shifts", 7/22 15:15-15:30.
  • ○Y. Ikabata, T. Nudejima, J. Seino, T. Yoshikawa, H. Nakai, "Machine-Learned Electron Correlation Model in the Form of Density Functional", 7/22 16:15-16:30.

Prof. Nakai gave an invited talk at ISTCP-X (Norway)

Prof. Nakai gave an invited talk at "Aspect of Heavy-Element Chemistry" session of 10th Triennial Congress of the International Society for Theoretical Chemical Physics (ISTCP-X).

Professor Nakai also served as the session chair for the large-scale session "Large-scale electronic structure models of materials".

Two other presentations were given from our research group.

Invited Talk

  • H. Nakai, "Relativistic density functional theory with picture-change corrected electron density", 2019/7/12 15:00-15:30.

Poster Presentation

  • ○T. M. Maier, Y. Ikabata, H. Nakai, "Relativistic 1s Core Orbital Shifts using Local Hybrid Functionals".
  • ○H. Uratani, C.-P. Chou, H. Nakai, "Divide-and-conquer DFTB-MD simulations of polaron formation process in a lead halide perovskite material".