http://sobereva.com/wfnbbs/viewtopic.php?id=1678 Sun, 22 Jun 2025 21:09:23 +0000 FluxBB http://sobereva.com/wfnbbs/viewtopic.php?pid=5151#p5151 There is no existing function for this purpose. Manually calculating it is easy: Using Multiwfn to simulate spectrum, export the two curves as text files,  import them into e.g. Origin, define a new column as their overlap, then perform numerical integration.

]]> Sun, 22 Jun 2025 21:09:23 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=5151#p5151 http://sobereva.com/wfnbbs/viewtopic.php?pid=5150#p5150 Dear Professor Tian-Lu
Is it possible to compute overlap integral between two spectra? I ask about in context of computing Dexter Energy Transfer rate.  Maybe Multiwfn has option to do it as well?
Cheers.

]]> Sat, 21 Jun 2025 11:29:01 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=5150#p5150