http://sobereva.com/wfnbbs/viewtopic.php?id=1760 Mon, 10 Nov 2025 13:32:35 +0000 FluxBB http://sobereva.com/wfnbbs/viewtopic.php?pid=5467#p5467 Connolly surface is defined for molecular surface, it is not a general surface for real-space functions. You can study isosurfaces of ESP.

]]> Mon, 10 Nov 2025 13:32:35 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=5467#p5467 http://sobereva.com/wfnbbs/viewtopic.php?pid=5466#p5466 Is it possible to obtain something like connolly surface from electrostatic potential, starting from a molden file? The molden file was generated from orca gbw file produced in a single point calculation.
thanks in advance
stefano

]]> Mon, 10 Nov 2025 12:17:19 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=5466#p5466