Search found 3 matches

by JasselM
Wed Jan 29, 2014 11:40 am
Forum: VTSTTools
Topic: VESTA Charge Density Plotting - Legend
Replies: 0
Views: 19401

VESTA Charge Density Plotting - Legend

Hi All, I am trying to create some charge density plot using VESTA and I am unable to find a tool that enables me to add a legend to my plots - so I have lots of pretty colours, but can't find a way to assign numerical values to those colours in the form of a scale. Has anyone done this kind of thin...
by JasselM
Fri Jan 10, 2014 10:42 am
Forum: VTSTTools
Topic: CHGDIFF.pl - Different atom numbers
Replies: 2
Views: 9264

Re: CHGDIFF.pl - Different atom numbers

Thanks so much - that's really helpful!
by JasselM
Thu Jan 09, 2014 4:13 pm
Forum: VTSTTools
Topic: CHGDIFF.pl - Different atom numbers
Replies: 2
Views: 9264

CHGDIFF.pl - Different atom numbers

HI, I was previously able to work out the charge difference between a 97 and 96 atom cell (one with an interstitial, and one pure system), but now I can't seem to get the script to do this subtraction. The error message I receive is: Atoms in file1: 97, Atoms in file2: 96 Points in file1: 6998400, P...