各位老师，EPR-III基组在哪儿有介绍？ EPR-III is a triple-zeta basis set including diffuse functions, double d-polarizations and a single set of f-polarization functions. 这是高斯网站上的介绍。EPR-III基组的在输入文件中的关键词是什么？
李老师，这个句子里的s66*8 是个什么意思The four necessary parameters have been determined by a fit to standard Boys and Bernadi counterpoise corrections for Hobza’s S66×8 set of non-covalently bound complexes
(528 data points)
各位老师我用orca中COSMO模型算溶剂效应对沥青质二聚体自聚稳定性的影响，但是审稿人说Simulation in two implicit solvent environments with very close (and low!) polarities such as toluene and hexane cannot reproduce the experimental solubility. Explicit all atom MD (perhaps, even with a polarizable force-field) could be of use here. One would naively expect that toluene should compete for the stacking interactions in contrast to hexane. 这个问题怎么回答，我全文都用的量化，只不过用MD做了构型搜索。
“The first and most important point is the fact that the authors apply the steady state approximation to the intermediates of their reactions. In my opinion, this is highly questionable. The authors have to demonstrate that this approximation is valid. One way to do that would be to solve the Master equation, for which they can use open-source codes like Mesmer (from Dr David Glowacki).”.