Yi Yang

4PUBLICATIONS
63CO-AUTHORS
Computational chemistryTheory and design of materialsPhotonics, optoelectronics and optical communications
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Publications (4)

|Nov 10, 2025
Efficient Molecular Crystal Structure Prediction and Stability Assessment with AIMNet2 Neural Network Potentials.

Kamal Singh Nayal, Dana O'Connor, Roman Zubatyuk

|Oct 30, 2025
Genarris 3.0: Generating Close-Packed Molecular Crystal Structures with Rigid Press.

Yi Yang, Rithwik Tom, Jose A G L Wui

|Oct 17, 2024
The seventh blind test of crystal structure prediction: structure ranking methods.

Lily M Hunnisett, Nicholas Francia, Jonas Nyman

|Mar 31, 2023
Inverse Design of Tetracene Polymorphs with Enhanced Singlet Fission Performance by Property-Based Genetic Algorithm Optimization.

Rithwik Tom, Siyu Gao, Yi Yang

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