Zezhu Zeng
6 Publications
2025 | Epub ahead of print | Journal Article | IST-REx-ID: 20011 |

Z. Zeng, X. Liang, Z. Fan, Y. Chen, M. Simoncelli, and B. Cheng, “Thermal transport of amorphous hafnia across the glass transition,” ACS Materials Letters. American Chemical Society, pp. 2695–2701, 2025.
[Published Version]
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2024 | Published | Journal Article | IST-REx-ID: 15359 |

H. Dong et al., “Molecular dynamics simulations of heat transport using machine-learned potentials: A mini-review and tutorial on GPUMD with neuroevolution potentials,” Journal of Applied Physics, vol. 135, no. 16. AIP Publishing, 2024.
[Preprint]
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| arXiv
2024 | Published | Journal Article | IST-REx-ID: 15052
R. Cheng, Z. Zeng, C. Wang, N. Ouyang, and Y. Chen, “Impact of strain-insensitive low-frequency phonon modes on lattice thermal transport in AxXB6-type perovskites,” Physical Review B, vol. 109, no. 5. American Physical Society, 2024.
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| DOI
2024 | Published | Journal Article | IST-REx-ID: 15311 |

Z. Zeng et al., “Pushing thermal conductivity to its lower limit in crystals with simple structures,” Nature Communications, vol. 15. Springer Nature, 2024.
[Published Version]
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| PubMed | Europe PMC
| arXiv
2023 | Published | Journal Article | IST-REx-ID: 14425 |

Z. Zeng et al., “Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations,” Nature Communications, vol. 14. Springer Nature, 2023.
[Published Version]
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| Files available
| DOI
| WoS
| PubMed | Europe PMC
| arXiv
Grants
6 Publications
2025 | Epub ahead of print | Journal Article | IST-REx-ID: 20011 |

Z. Zeng, X. Liang, Z. Fan, Y. Chen, M. Simoncelli, and B. Cheng, “Thermal transport of amorphous hafnia across the glass transition,” ACS Materials Letters. American Chemical Society, pp. 2695–2701, 2025.
[Published Version]
View
| DOI
| Download Published Version (ext.)
2024 | Published | Journal Article | IST-REx-ID: 15359 |

H. Dong et al., “Molecular dynamics simulations of heat transport using machine-learned potentials: A mini-review and tutorial on GPUMD with neuroevolution potentials,” Journal of Applied Physics, vol. 135, no. 16. AIP Publishing, 2024.
[Preprint]
View
| Files available
| DOI
| arXiv
2024 | Published | Journal Article | IST-REx-ID: 15052
R. Cheng, Z. Zeng, C. Wang, N. Ouyang, and Y. Chen, “Impact of strain-insensitive low-frequency phonon modes on lattice thermal transport in AxXB6-type perovskites,” Physical Review B, vol. 109, no. 5. American Physical Society, 2024.
View
| DOI
2024 | Published | Journal Article | IST-REx-ID: 15311 |

Z. Zeng et al., “Pushing thermal conductivity to its lower limit in crystals with simple structures,” Nature Communications, vol. 15. Springer Nature, 2024.
[Published Version]
View
| Files available
| DOI
| PubMed | Europe PMC
| arXiv
2023 | Published | Journal Article | IST-REx-ID: 14425 |

Z. Zeng et al., “Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations,” Nature Communications, vol. 14. Springer Nature, 2023.
[Published Version]
View
| Files available
| DOI
| WoS
| PubMed | Europe PMC
| arXiv