Quantum Inverse Algorithm via Adaptive Variational Quantum Linear Solver: Applications to General Eigenstates

被引:5
|
作者
Yoshikura, Takahiro [1 ]
Ten-no, Seiichiro L. [1 ]
Tsuchimochi, Takashi [1 ,2 ]
机构
[1] Kobe Univ, Grad Sch Syst Informat, Nada Ku, Kobe, Hyogo 6578501, Japan
[2] Japan Sci & Technol Agcy JST, Precursory Res Embryon Sci & Technol PRESTO, Saitama 3320012, Japan
来源
JOURNAL OF PHYSICAL CHEMISTRY A | 2023年 / 127卷 / 31期
关键词
Eigenstates - Energy - Excited-states - Initial state - Inverse algorithm - Linear solver - Power - Power state - Quantum circuit - Singularity-free;
D O I
10.1021/acs.jpca.3c02800
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We propose a quantum inverse algorithm (QInverse) todirectly determinegeneral eigenstates by repeatedly applying the inverse power of ashifted Hamiltonian to an arbitrary initial state. To properly dealwith the strongly entangled inverse power states and the resultantexcited states, we solved the underlying linear equation, both variationallyand adaptively, to obtain a faithful inverse power state with a shallowquantum circuit. QInverse is singularity-free and successfully obtainsthe target excited states with an energy closest to the shift & omega;,which is difficult to reach using variational methods. We also proposea subspace expansion approach to accelerate convergence and show thatit is helpful to determine the two nearest eigenvalues when they areequally close to & omega;. These approaches were compared with thefolded-spectrum method, which aims to generate excited states throughvariational optimization. It is shown that, whereas the folded-spectrumapproach often fails to predict the target state by falling into alocal minimum owing to its variational features, the success rateand accuracy of our algorithms are systematically improvable.
引用
收藏
页码:6577 / 6592
页数:16
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