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Cheng-Han Li

7PUBLICATIONS

14CO-AUTHORS

Theoretical quantum chemistryPolymers and plasticsPolymerisation mechanismsChemical and thermal processes in energy and combustionElectrical energy generation (incl. renewables, excl. photovoltaics)

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Publications (7)

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|Oct 27, 2025

GPU-Accelerated Graph-Based Semiempirical Quantum Chemistry.

Maksim Kulichenko, Robert M Stanton, Cheng-Han Li

|Mar 14, 2025

Shadow Molecular Dynamics with a Machine Learned Flexible Charge Potential.

Cheng-Han Li, Mehmet Cagri Kaymak, Maksim Kulichenko

|Jun 28, 2024

Structural, Ionic, and Electronic Properties of Solid-State Phthalimide-Containing Polymers for All-Organic Batteries.

Riccardo Alessandri, Cheng-Han Li, Sheila Keating

|Feb 15, 2024

Charge Transfer in Spatially Defined Organic Radical Polymers.

Ting Ma, Evan Fox, Miao Qi

|Oct 20, 2023

Generative organic electronic molecular design informed by quantum chemistry.

Cheng-Han Li, Daniel P Tabor

|Apr 05, 2023

Reorganization Energy Predictions with Graph Neural Networks Informed by Low-Cost Conformers.

Cheng-Han Li, Daniel P Tabor

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Frequent Collaborators

6 joint publications

Daniel P Tabor

3 joint publications

Jodie L Lutkenhaus

2 joint publications

Ting Ma

2 joint publications

Nicholas Lubbers

2 joint publications

Sergei Tretiak

2 joint publications

Joshua Finkelstein

1 joint publications

Riccardo Alessandri

1 joint publications

Sheila Keating

1 joint publications

Stuart J Rowan

1 joint publications

Juan J de Pablo

Frequent Collaborators

6 joint publications

Daniel P Tabor

3 joint publications

Jodie L Lutkenhaus

2 joint publications

Ting Ma

2 joint publications

Nicholas Lubbers

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