标题: 量化计算在生物质热解反应机理的应用综述 [打印本页] 作者Author: kevin 时间: 2020-9-17 16:55 标题: 量化计算在生物质热解反应机理的应用综述 Energy & Fuels第34期封面文章，《Recent Progress in Quantum Chemistry Modeling on the Pyrolysis Mechanisms of Lignocellulosic Biomass》 https://pubs.acs.org/toc/enfuem/34/9
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本人第一篇综述，推荐一下，欢迎批评作者Author: niobium 时间: 2020-9-17 19:21
膜作者Author: Mikasa 时间: 2020-9-18 14:17
The last paragraph on page 10386: "At 0 K, electronic energy, thermal energy, enthalpy, and Gibbs free energy have the same value."
This is absolutely not correct!
At 0K, the (electronic energy) + ZPE = enthalpy = Gibbs free energy作者Author: kevin 时间: 2020-9-24 11:29
Mikasa 发表于 2020-9-18 14:17
The last paragraph on page 10386: "At 0 K, electronic energy, thermal energy, enthalpy, and Gibbs fr ...
