Predicting thermodynamic stability of inorganic compounds using ensemble machine learning based on electron configuration
Abstract Machine learning offers a promising avenue for expediting the discovery of new compounds by accurately predicting their thermodynamic stability. This approach provides significant advantages in terms of time and resource efficiency compared to traditional experimental and modeling methods....
Saved in:
| Main Authors: | Hao Zou, Haochen Zhao, Mingming Lu, Jiong Wang, Zeyu Deng, Jianxin Wang |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2025-01-01
|
| Series: | Nature Communications |
| Online Access: | https://doi.org/10.1038/s41467-024-55525-y |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Similar Items
-
Towards the mechanical stability of biocrusts in drylands: Insights from inorganic ions and organic compounds and their interactions
by: Xingxing Yu, et al.
Published: (2024-11-01) -
Photo-Electron Spectrometry of Inorganic Solids
by: Christian Klixbüll Jorgensen
Published: (1971-07-01) -
Ensemble and transfer learning of soil inorganic carbon with visible near-infrared spectra
by: Yu Wang, et al.
Published: (2025-04-01) -
Ensemble learning for prediction of inorganic scale formation: A case study in Oman
by: Mohammed Talib Said Al Harrasi, et al.
Published: (2025-07-01) -
Structural stability, electronic, and thermodynamic insights into Ribociclib encapsulation in PEG-functionalized ZnO nanocarriers
by: Mahboubeh Pishnamazi, et al.
Published: (2025-10-01)