Hiromi Nakai

13PUBLICATIONS
7CO-AUTHORS
Multiphysics flows (incl. multiphase and reacting flows)Theoretical quantum chemistryChemical thermodynamics and energeticsMain group metal chemistryAerodynamics (excl. hypersonic aerodynamics)
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Publications (13)

|Jul 09, 2021
Assessing locally range-separated hybrid functionals from a gradient expansion of the exchange energy density.

Toni M Maier, Yasuhiro Ikabata, Hiromi Nakai

|Nov 14, 2020
Machine-learned electron correlation model based on frozen core approximation.

Yasuhiro Ikabata, Ryo Fujisawa, Junji Seino

|Jul 03, 2020
Finite-temperature-based time-dependent density-functional theory method for static electron correlation systems.

Takeshi Yoshikawa, Toshiki Doi, Hiromi Nakai

|Jun 15, 2020
Non-adiabatic molecular dynamics with divide-and-conquer type large-scale excited-state calculations.

Hiroki Uratani, Hiromi Nakai

|Jun 08, 2020
Relativistic local hybrid functionals and their impact on 1s core orbital energies.

Toni M Maier, Yasuhiro Ikabata, Hiromi Nakai

|Apr 17, 2020
Unveiling controlling factors of the S0/S1 minimum energy conical intersection (2): Application to penalty function method.

Mayu Inamori, Yasuhiro Ikabata, Takeshi Yoshikawa

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