Chenyang Li

发表

Francesco A. Evangelista, Chenyang Li, 2018, The Journal of chemical physics.

Multireference Driven Similarity Renormalization Group: A Second-Order Perturbative Analysis.

Francesco A. Evangelista, Chenyang Li, 2015, Journal of chemical theory and computation.

Conjugated Oligomers with Stable Radical Substituents: Synthesis, Single Crystal Structures, Electronic Structure, and Excited State Dynamics

Francesco A. Evangelista, T. Lian, K. Warncke, 2018, Chemistry of Materials.

Leveraging Small-Scale Quantum Computers with Unitarily Downfolded Hamiltonians

Francesco A. Evangelista, Chenyang Li, Ren-dong Huang, 2022, PRX Quantum.

Theoretical Calculation of Core-Excited States along Dissociative Pathways beyond Second-Order Perturbation Theory.

Francesco A. Evangelista, Meng Huang, Chenyang Li, 2021, Journal of chemical theory and computation.

An integral-factorized implementation of the driven similarity renormalization group second-order multireference perturbation theory.

Francesco A. Evangelista, Kevin P Hannon, Chenyang Li, 2016, The Journal of chemical physics.

Analytic Energy Gradients for the Driven Similarity Renormalization Group Multireference Second-Order Perturbation Theory.

Francesco A. Evangelista, Chenyang Li, Shuhe Wang, 2021, Journal of chemical theory and computation.

Tuning QD/mediator Interface for Optimal Efficiency of Quantum Dot Sensitized Near Infrared to Visible Photon Upconversion Systems.

Francesco A. Evangelista, T. Lian, Zhiyuan Huang, 2020, ACS applied materials & interfaces.

Assessment of State-Averaged Driven Similarity Renormalization Group on Vertical Excitation Energies: Optimal Flow Parameters and Applications to Nucleobases.

M. Wang, W. Fang, Chenyang Li, 2022, Journal of chemical theory and computation.

The remarkable [ReH9]2- dianion: molecular structure and vibrational frequencies.

H. Schaefer, Jay Agarwal, Chenyang Li, 2014, The journal of physical chemistry. B.

Intricate internal rotation surface and fundamental infrared transitions of the n-propyl radical.

W. D. Allen, H. Schaefer, Jay Agarwal, 2015, The journal of physical chemistry. B.

Reactivity regulation of B/KNO3/PVDF energetic sticks prepared by direct ink writing

Chunyan Li, Baoyun Ye, Chuanhao Xu, 2022, Chemical Engineering Journal.

Second-Order Active-Space Embedding Theory.

Francesco A. Evangelista, Chenyang Li, Nan He, 2022, Journal of chemical theory and computation.

A Combined Selected Configuration Interaction and Many-Body Treatment of Static and Dynamical Correlation in Oligoacenes.

Jeffrey B Schriber, Francesco A Evangelista, Chenyang Li, 2018, Journal of chemical theory and computation.

Analytic gradients for the single-reference driven similarity renormalization group second-order perturbation theory.

Francesco A. Evangelista, Chenyang Li, Shuhe Wang, 2019, The Journal of chemical physics.

Francesco A. Evangelista, Chenyang Li, 2017, The Journal of chemical physics.

Spin-free formulation of the multireference driven similarity renormalization group: A benchmark study of first-row diatomic molecules and spin-crossover energetics.

Francesco A. Evangelista, Chenyang Li, 2021, The Journal of chemical physics.

Connected three-body terms in single-reference unitary many-body theories: Iterative and perturbative approximations.

Francesco A. Evangelista, Chenyang Li, 2020, The Journal of chemical physics.

Improving the efficiency of the multireference driven similarity renormalization group via sequential transformation, density fitting, and the non-interacting virtual orbital approximation.

Chenyang Li, Tianyuan Zhang, Francesco A. Evangelista, 2019, Journal of chemical theory and computation.

Towards numerically robust multireference theories: The driven similarity renormalization group truncated to one- and two-body operators.

Francesco A Evangelista, Chenyang Li, Francesco A. Evangelista, 2016, The Journal of chemical physics.

Dynamically weighted multireference perturbation theory: Combining the advantages of multi-state and state-averaged methods.

Francesco A. Evangelista, R. Lindh, Chenyang Li, 2019, The Journal of chemical physics.

Multireference Theories of Electron Correlation Based on the Driven Similarity Renormalization Group.

Francesco A Evangelista, Chenyang Li, Francesco A. Evangelista, 2019, Annual review of physical chemistry.

A low-cost approach to electronic excitation energies based on the driven similarity renormalization group.

Francesco A. Evangelista, Kevin P Hannon, P. Verma, 2017, The Journal of chemical physics.

Frozen natural orbitals for the state-averaged driven similarity renormalization group

Francesco A. Evangelista, Chenyang Li, Ren-dong Huang, 2023, 2312.07008.

A low-cost approach to electronic excitation energies based on the driven similarity renormalization group.

Francesco A. Evangelista, Kevin P Hannon, P. Verma, 2017, The Journal of chemical physics.