<![CDATA[Multiwfn forum / ORCA and Multiwfn]]> - //www.umsyar.com/wfnbbs/viewtopic.php?id=814 Fri, 21 Apr 2023 09:46:34 +0000 FluxBB <![CDATA[Re: ORCA and Multiwfn]]> //www.umsyar.com/wfnbbs/viewtopic.php?pid=3108#p3108 Please clarify which analysis you want to perform via Multiwfn.

Most wavefunction analysis functions in Multiwfn can use .molden file of ORCA as input file, see beginning of Chapter 4 of Multiwfn manual on how to generate it via ORCA.

]]> Fri, 21 Apr 2023 09:46:34 +0000 //www.umsyar.com/wfnbbs/viewtopic.php?pid=3108#p3108 <![CDATA[ORCA and Multiwfn]]> //www.umsyar.com/wfnbbs/viewtopic.php?pid=3107#p3107 How to generate file for multiwfn from ORCA output file?

]]> Fri, 21 Apr 2023 06:33:26 +0000 //www.umsyar.com/wfnbbs/viewtopic.php?pid=3107#p3107