Hi again.
Can someone please tell me where is the isosurface information located within the .cube files, i plan on building my own for use as orbitals on other molecules as separate files.
I checked some .cube files like
ch3cl-density.cub.gz and o2h2_1_04.cube.gz , all i see are 6 fields, frist in continuum and the following 5 with a separatin row each 9 rows.
Maybe a tutorial is in order, i'll be glad to contribute.
Thank you
- [Jmol-users] Isosurface and .cube files Einar Coutin
- Re: [Jmol-users] Isosurface and .cube files Nicolas Vervelle
- Re: [Jmol-users] Isosurface and .cube files Bob Hanson

