Towards fully ab initio simulation of atmospheric aerosol nucleation

Atmosphere aerosol nucleation contributes to climate change, air pollution, and human health, however the mechanisms are complex and elusive. Here the authors propose a general workflow based on deep neural network-based force field, paving the way towards fully ab initio simulation of atmospheric a...

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Bibliographic Details
Main Authors: Shuai Jiang, Yi-Rong Liu, Teng Huang, Ya-Juan Feng, Chun-Yu Wang, Zhong-Quan Wang, Bin-Jing Ge, Quan-Sheng Liu, Wei-Ran Guang, Wei Huang
Format: Article
Language:English
Published: Nature Portfolio 2022-10-01
Series:Nature Communications
Online Access:https://doi.org/10.1038/s41467-022-33783-y