量化计算在生物质热解反应机理的应用综述

kevin

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
截止发稿前还可以开放获取
本人第一篇综述，推荐一下，欢迎批评

niobium

膜

Mikasa

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

kevin

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 ...

多谢您指出，这个确实是错的。正在联系勘误。