Theory and Applications of Computational Chemistry (TACC2023) において、中井教授による招待講演と当研究室のポスター発表が6件あります。
Date: 2023年9月4日(月)～9月9日(土)
Place: 北海道大学, Sapporo, Japan
発表内容
- 〇Hiromi Nakai，”Chemical Concept for Understanding the S0/S1 Minimum Energy Conical Intersection”(Invited Talk).
- 〇Yoshifumi Nishimura, Hiromi Nakai，”Extension and acceleration of nanoreactor molecular dynamics based on species-selective algorithm and linear-scaling tight-binding quantum chemical computations”(poster).
- 〇Chinami Takashima and Hiromi Nakai，”Long-range corrected density functional theory calculation with the infinite-order two-component Hamiltonian”(poster).
- 〇Ryo Fujisawa, Mikito Fujinami, Hiromi Nakai，”Development of machine-learned electron correlation model including the fourth-row elements”(poster).
- 〇Ryusei Nishimura, Takeshi Yoshikawa, Kent Sakata, Hiromi Nakai，”Main Configuration Analysis for Divide-and-Conquer Excited-State Calculations using Frequency-Dependent Polarizability”(poster).
- 〇Ryosuke Sasaki, Mikito Fujinami, Hiromi Nakai，”Utilization of image recognition for chemical experiments toward development of automated electronic laboratory notebook”(poster).
- 〇Rei Oshima, Chinami Takashima, Kazuki Tajima, Takeshi Yoshikawa, Hiromi Nakai，”Solving unstable behavior of divide-and-conquer self-consistent field calculations using level shift technique based on pair-excited perturbative selection”(poster)