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Updated: May 11, 2026

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铁的机制 (II) 血上的化学吸收 (001) 通过反应性神经网络潜在分子动力学揭示

Kit Joll1, Philipp Schienbein1,2,3, Kevin M Rosso4

  • 1Department of Physics and Astronomy and Thomas Young Centre, University College London, London WC1E 6BT, United Kingdom.

The journal of physical chemistry letters
|January 17, 2025
PubMed
概括

一个新的机器学习模型准确地模拟了原子层面的地球化学过程. 这种反应性神经网络的潜在分子动力学方法提高了我们对矿物表面离子相互作用的理解.

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相关概念视频

Colors and Magnetism03:02

Colors and Magnetism

Color in Coordination Complexes
When atoms or molecules absorb light at the proper frequency, their electrons are excited to higher-energy orbitals. For many main group atoms and molecules, the absorbed photons are in the ultraviolet range of the electromagnetic spectrum, which cannot be detected by the human eye. For coordination compounds, the energy difference between the d orbitals often allows photons in the visible range to be absorbed and emitted, which is seen as colors by the human...
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