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#1 Multiwfn and wavefunction analysis ? units ? 2021-07-29 18:26:43
- linda
- Replies: 1
Hi,
I have found in the manual that "all units are in atomic unit (a.u.)" and also "Atomic unit for electron density can be explicitly written as |e|/Bohr3". Are all topological parameters (like laplacian of electron density, total energy density etc) are in terms of Bohr?
Thank you
#2 Multiwfn and wavefunction analysis ? contour plots of laplacian ? 2020-11-24 09:37:43
- linda
- Replies: 1
Hi
I'm new to multiwfn. Whlie plotting i had difficulty in changing the font and size of axis labels. How can I increase or decrease the axis label for contour plots of laplacian?
Thank You
#3 Multiwfn and wavefunction analysis ? contour plots of laplacian ? 2020-08-27 16:08:36
- linda
- Replies: 1
Hi
I am trying to plot the Contour maps of the Laplacian distribution of electron density in the plane for NHC. I'm attaching herewith the plot i obtained. I would like to rotate the molecule in this plot 90degree to the right. How can I rotate this?
Thank you in advance for the reply
Linda
Pages: 1