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Manyi Yang

3PUBLICATIONS
9CO-AUTHORS
Formal methods for softwareComputational chemistryCatalysis and mechanisms of reactions
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Journal

Publications (3)

Sort by Publication Date:
|Oct 01, 2025
Phase diagram of CO2-I/III from molecular dynamics simulation using a PBE0-accuracy machine learning potential.

Benkun Hong, Guoao Li, Pei Liu

|Aug 27, 2025
Ab Initio Accuracy Neural Network Potential for Drug-Like Molecules.

Manyi Yang, Duo Zhang, Xinyan Wang

|Mar 01, 2024
Structure and polymerization of liquid sulfur across the λ-transition.

Manyi Yang, Enrico Trizio, Michele Parrinello

Pageof 1

Frequent Collaborators

1 joint publications

Enrico Trizio

1 joint publications

Michele Parrinello

1 joint publications

Tong Zhu

1 joint publications

Han Wang

1 joint publications

Benkun Hong

1 joint publications

Guoao Li

1 joint publications

Pei Liu

1 joint publications

Wei Li

1 joint publications

Shuhua Li

Frequent Collaborators

1 joint publications

Enrico Trizio

1 joint publications

Michele Parrinello

1 joint publications

Tong Zhu

1 joint publications

Han Wang

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