Hirotoshi Hirai
7PUBLICATIONS
3CO-AUTHORS
Get your video featured.
Publish with JoVEGet your video featured.
Publish with JoVE
Publications (7)
Sort by Publication Date:
|Sep 15, 2025
Enhancing Accuracy of Quantum-Selected Configuration Interaction Calculations Using Multireference Perturbation Theory: Application to Aromatic Molecules.Soichi Shirai, Shih-Yen Tseng, Hokuto Iwakiri
|Aug 19, 2024
Construction of Antisymmetric Variational Quantum States with Real Space Representation.Takahiro Horiba, Soichi Shirai, Hirotoshi Hirai
|Jun 12, 2023
Computational Analysis of Chemical Reactions Using a Variational Quantum Eigensolver Algorithm without Specifying Spin Multiplicity.Soichi Shirai, Hokuto Iwakiri, Keita Kanno
|Sep 12, 2022
Discovering surface reaction pathways using accelerated molecular dynamics and network analysis tools.Hirotoshi Hirai, Ryosuke Jinnouchi
|Jun 27, 2022
Mechanisms of temperature-dependent oxygen absorption/release and appearance of intermediate phase in κ-Ce2Zr2O8: study based on oxygen vacancy formation energy computations.Hirotoshi Hirai, Ryosuke Jinnouchi
|Jun 20, 2022
Molecular Structure Optimization Based on Electrons-Nuclei Quantum Dynamics Computation.Hirotoshi Hirai, Takahiro Horiba, Soichi Shirai
Pageof 2
