<![CDATA[Multiwfn forum / values: ELF]]> http://sobereva.com/wfnbbs/viewtopic.php?id=1002 Wed, 08 May 2024 14:23:57 +0000 FluxBB <![CDATA[Re: values: ELF]]> http://sobereva.com/wfnbbs/viewtopic.php?pid=3811#p3811 Section 4.5.3 of Multiwfn manual clearly illustrated how to obtain exact bifurcation value for ELF-pi and ELF-sigma by topology analysis. After obtaining the values, manually taking their average.

]]> Wed, 08 May 2024 14:23:57 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=3811#p3811 <![CDATA[Re: values: ELF]]> http://sobereva.com/wfnbbs/viewtopic.php?pid=3810#p3810 Yes I want to obtain mean bifurcation values of ELFσ and ELFπ. Study of the influence of substituents on the delocalization of pi electrons in polyphenol chains

]]> Wed, 08 May 2024 11:51:24 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=3810#p3810 <![CDATA[Re: values: ELF]]> http://sobereva.com/wfnbbs/viewtopic.php?pid=3808#p3808 I don't know what is ELFs and ELFp, do you mean ELF-sigma and ELF-pi?

I also don't know what do you want to obtain exactly, do you mean bifurcation value?

]]> Tue, 07 May 2024 18:16:19 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=3808#p3808 <![CDATA[values: ELF]]> http://sobereva.com/wfnbbs/viewtopic.php?pid=3807#p3807 how can I get only the values: total ELF, ELFs and ELFp, without drawings. I can make drawings.

]]> Tue, 07 May 2024 18:13:59 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=3807#p3807