<![CDATA[Multiwfn forum / Intrinsic Atomic Orbitals analysis in Multiwfn]]>
http://www.shanxitv.org/wfnbbs/viewtopic.php?id=247
Thu, 21 Nov 2019 10:28:24 +0000FluxBB<![CDATA[Re: Intrinsic Atomic Orbitals analysis in Multiwfn]]>
http://www.shanxitv.org/wfnbbs/viewtopic.php?pid=760#p760
I noticed this method before, but I tend to first implement natural population analysis (NPA), which can generate natural atomic orbitals as a byproduct, I believe this is more meaningful than IAO.]]>Thu, 21 Nov 2019 10:28:24 +0000http://www.shanxitv.org/wfnbbs/viewtopic.php?pid=760#p760<![CDATA[Intrinsic Atomic Orbitals analysis in Multiwfn]]>
http://www.shanxitv.org/wfnbbs/viewtopic.php?pid=759#p759
Hi,
Is there any plan to support Gerald Knizia's Intrinsic Atomic Orbitals analysis in Multiwfn?