Qi Gao

发表

Calculating transition amplitudes by variational quantum eigensolvers

Yuya O. Nakagawa, Takao Kobayashi, K. Mitarai, 2020 .

Excited state calculations using variational quantum eigensolver with spin-restricted ansätze and automatically-adjusted constraints

Qi Gao, M. Hatanaka, Taichi Inagaki, 2021, npj Computational Materials.

Applications of quantum computing for investigations of electronic transitions in phenylsulfonyl-carbazole TADF emitters

Hiroshi C. Watanabe, M. Motta, Eriko Watanabe, 2020, npj Computational Materials.

Computational Investigations of the Lithium Superoxide Dimer Rearrangement on Noisy Quantum Devices.

Marco Pistoia, Tanvi P. Gujarati, Naoki Yamamoto, 2019, The journal of physical chemistry. A.

Analytical Energy Gradient for State-Averaged Orbital-Optimized Variational Quantum Eigensolvers and Its Application to a Photochemical Reaction.

Yuya O. Nakagawa, W. Mizukami, Qi Gao, 2021, Journal of chemical theory and computation.

Enhancement of Complete Active Space Self-Consistent Field (CASSCF) Calculation Accuracy on Noisy Quantum Device: Use of Spin-Restricted Ansatz and Constrained Optimizer for Photo-Excitation Calculations of Ethylene and Phenol Blue Dye

Qi Gao, M. Hatanaka, Taichi Inagaki, 2021 .

Calculating transition amplitudes by variational quantum deflation

Yuya O. Nakagawa, Takao Kobayashi, K. Mitarai, 2020, Physical Review Research.

Analysis and synthesis of feature map for kernel-based quantum classifier

Tomoki Tanaka, Qi Gao, N. Yamamoto, 2019, Quantum Mach. Intell..

Natural quantum reservoir computing for temporal information processing

K. Pradel, K. Yasuoka, Qi Gao, 2021, Scientific Reports.

Quantum-Classical Computational Molecular Design of Deuterated High-Efficiency OLED Emitters

M. Sugawara, Qi Gao, Gavin O. Jones, 2021, Intelligent Computing.