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Updated: Jun 14, 2025

Simulation of Early Earth Hydrothermal Chimneys in a Thermal Gradient Environment
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Ab Initio 在没有人工高温的情况下模拟液态水

Chenyu Wang1, Wei Tian1, Ke Zhou1

  • 1College of Energy, Soochow Institute for Energy and Materials InnovationS (SIEMIS), Jiangsu Provincial Key Laboratory for Advanced Carbon Materials and Wearable Energy Technologies, Soochow University, Suzhou 215006, China.

Journal of chemical theory and computation
|September 2, 2024
PubMed
概括

一种新的计算方法,规范化SCAN (rSCAN),准确地模拟了液态水的结构和环境条件下的动态. 这种方法消除了对人工高温的需求,改善了水系统的模拟.

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