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Author

Chao Liu

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Open access Aug 2026

A Triple-Site Engineered Heterojunction Photocatalyst for Full-Spectrum NH3 Synthesis via Synergistic Promotion of Water Oxidation and Nitrate Reduction.

Photocatalytic nitrate reduction reaction (NitRR) represents a sustainable approach to convert nitrate pollutants to valuable NH3. However, the performance of state-of-the-art photocatalysts is hampered by insufficient near-infrared (NIR) light utilization and sluggish kinetics of hydrogenation steps and coupled water-...

Yamin Xi, Shunqiong Long, Jing Wang et al. · 0 citations
Aug 2026

Resource-Efficient Simulation of Molecular Ground and Excited States Based on Contextual Subspace and Quantum Subspace Expansion.

Predicting spectra and photochemical pathways relies on the computation of molecular excited states. However, the practicality of near-term variational quantum algorithms is threatened by the prohibitive growth of measurement overheads. Integrating Quantum Subspace Expansion with the Contextual Subspace (CS) method, we...

Chao Liu, Yuxin Deng · 0 citations

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