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Zhenyu Li

Director

University of Science and Technology of China

China

Research Interests

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Articles (20)

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Collaborators (9)

Hua Guo

Associate/Full/Distinguished Professor

University of New Mexico

UNITED STATES

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Jin-Shi Xu

University of Science and Technology of China

CHINA

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Bin Jiang

Professor

University of Science and Technology of China

CHINA

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Xiang Shao

Professor

University of Science and Technology of China

CHINA

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Jie Liu

Research Professor

University of Science and Technology of China

CHINA

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Xi Lu

Professor

University of Science and Technology of China

CHINA

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MARIA PERESSI

Full Professor

University of Trieste

ITALY

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Abdelkader Kara

Professor

University of Central Florida

UNITED STATES

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Ernst Meyer

Full Professor

University of Basel

SWITZERLAND

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Zhenyu Li

Research Interests

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Articles (20)

Qubit-Adaptive Variational Quantum Imaginary Time Evolution: A Resource-Efficient Algorithm for Ground-State Preparation of Correlated Molecules on Near-Term Quantum Computers

Revealing the Atomic Structure of Blue Phosphorus Phases on Au(111) with Noncontact Atomic Force Microscopy

Perturbative Variational Quantum Eigensolver via Reduced Density Matrices

First principles reactive flux theory for surface reactions revealing multiple channels and recrossing dynamics

Quantum Landscape of Precision Chemistry

Mechanistic Insights into Ammonia Synthesis from Nitrogen and Water Microdroplets

Valence‐Dependent Overscreening and Charging Pathways in Aqueous Electric Double Layers

Theoretical Perspectives of Precision Chemistry

Accurate Vibrational Frequency Calculations for Quantum Computing via an Analytic Second-Order Energy Derivative Framework

Integrating quantum neural networks with the variational quantum eigensolver to calculate nonadiabatic coupling vectors

Is Iodine Interstitial a Recombination Center in FAPbI3? Effects of Temperature Revisited

Atomistic visualization of formaldehyde degradation on the ZnO surface through a Mars-van Krevelen mechanism

Hamiltonian-Guided Autoregressive Selected-Configuration Interaction Achieves Chemical Accuracy in Strongly Correlated Systems

Variational-quantum-eigensolver solution for Lindblad-driven nonequilibrium electron-transport problems

Accurate Chemical Reaction Modeling on a Noisy Intermediate-Scale Quantum Computer with an Active Space-Based Workflow

Nonmonomer Evaporation from Molecular Clusters at Low Temperature via a Ring-Reconstruction Mechanism

Sulfur-driven promotion of CO tolerance in PEMFCs

Engineering Bifunctional Oxygen Electrocatalysts in 2D Conjugated Metal–Organic Frameworks: Theoretical Perspectives on Metal–Ligand Synergistic Effects

Variational quantum simulation of time-local quantum master equations via quantum jump

Diastereodivergent synthesis of multi-substituted cycloalkanes

Collaborators (9)

Hua Guo

Jin-Shi Xu

Bin Jiang

Xiang Shao

Jie Liu

Xi Lu

MARIA PERESSI

Abdelkader Kara

Ernst Meyer

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